#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ce8 n PRO 2 N 0.00 0.94 -2.58 0.03 -0.04 -1.26 -3.54 135.00 128.55 1ce8 n PRO 2 Ca 0.00 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.08 1ce8 n PRO 2 Cb 0.00 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.41 1ce8 n PRO 2 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1ce8 s LYS 3 N -0.14 4.48 0.10 0.54 -2.85 -1.26 -3.66 119.74 116.95 1ce8 s LYS 3 Ca 0.00 1.58 -0.36 0.00 -1.00 0.00 0.00 55.97 56.19 1ce8 s LYS 3 Cb 0.00 -2.89 -0.16 0.00 -2.06 0.00 0.00 37.83 32.71 1ce8 s LYS 3 CO 0.00 0.13 1.37 0.54 0.10 0.00 0.00 175.35 177.48 1ce8 n ARG 4 N 0.65 1.31 -0.12 1.78 1.74 0.22 -4.94 116.66 117.29 1ce8 n ARG 4 Ca 0.02 0.47 -0.27 0.00 -0.77 0.00 0.00 57.85 57.30 1ce8 n ARG 4 Cb 0.48 -2.12 -0.11 0.00 -1.02 0.00 0.00 32.46 29.69 1ce8 n ARG 4 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 1ce8 n THR 5 N 2.59 1.54 0.00 0.55 5.66 -1.26 -4.30 114.28 119.06 1ce8 n THR 5 Ca 0.18 -0.30 0.00 0.00 -3.05 0.00 0.00 64.05 60.88 1ce8 n THR 5 Cb 0.21 -1.90 0.00 0.00 -1.55 0.00 0.00 70.33 67.09 1ce8 n THR 5 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1ce8 n ASP 6 N -4.22 0.00 -4.18 1.09 5.68 -1.26 -4.54 116.55 109.11 1ce8 n ASP 6 Ca -0.47 0.34 -0.33 0.00 -0.50 0.00 0.00 54.79 53.83 1ce8 n ASP 6 Cb 0.84 -0.34 -0.16 0.00 -1.14 0.00 0.00 41.12 40.32 1ce8 n ASP 6 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1ce8 s ILE 7 N -2.67 2.18 0.00 2.12 1.01 -1.26 -5.00 121.20 117.59 1ce8 s ILE 7 Ca 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 60.65 59.72 1ce8 s ILE 7 Cb 0.00 -1.89 0.00 0.00 0.01 0.00 0.00 42.46 40.58 1ce8 s ILE 7 CO 0.00 0.54 0.00 0.29 0.00 0.00 0.00 174.94 175.77 1ce8 n LYS 8 N 4.12 2.08 -4.93 2.79 5.02 -1.26 -4.93 118.16 121.05 1ce8 n LYS 8 Ca -0.20 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.77 1ce8 n LYS 8 Cb 0.51 -0.97 -0.14 0.00 -0.02 0.00 0.00 35.03 34.41 1ce8 n LYS 8 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1ce8 s SER 9 N -3.35 3.80 -0.09 4.39 1.04 -1.26 -0.80 113.70 117.42 1ce8 s SER 9 Ca 0.00 -0.33 0.04 0.00 0.48 0.00 0.00 55.95 56.14 1ce8 s SER 9 Cb 0.00 -1.23 0.00 0.00 0.10 0.00 0.00 66.02 64.89 1ce8 s SER 9 CO 0.00 0.24 -0.22 -0.63 0.98 0.00 0.00 173.24 173.61 1ce8 s ILE 10 N -0.08 1.88 -0.23 -1.02 1.01 0.42 -0.03 121.20 123.16 1ce8 s ILE 10 Ca -0.03 -0.92 -0.10 0.00 0.00 0.00 0.00 60.65 59.59 1ce8 s ILE 10 Cb -0.14 -1.63 -0.05 0.00 0.01 0.00 0.00 42.46 40.65 1ce8 s ILE 10 CO 0.04 0.52 0.15 -0.22 0.00 0.00 0.00 174.94 175.43 1ce8 s LEU 11 N 0.34 4.08 -0.23 2.97 2.96 0.21 -0.87 118.68 128.14 1ce8 s LEU 11 Ca -0.16 0.11 -0.06 0.00 -0.22 0.00 0.00 54.13 53.79 1ce8 s LEU 11 Cb -0.17 -2.09 -0.03 0.00 0.50 0.00 0.00 46.19 44.41 1ce8 s LEU 11 CO 0.07 0.08 0.04 -0.63 -1.32 0.00 0.00 176.35 174.59 1ce8 s ILE 12 N 0.97 4.11 -0.27 6.68 1.01 0.52 0.51 121.20 134.73 1ce8 s ILE 12 Ca 0.07 -0.24 -0.26 0.00 0.00 0.00 0.00 60.65 60.22 1ce8 s ILE 12 Cb -0.13 -2.90 0.00 0.00 0.01 0.00 0.00 42.46 39.44 1ce8 s ILE 12 CO 0.04 0.37 0.89 -0.76 0.00 0.00 0.00 174.94 175.48 1ce8 s LEU 13 N 1.43 4.06 0.63 2.97 1.43 -1.08 -1.76 118.68 126.36 1ce8 s LEU 13 Ca 0.05 0.99 -0.11 0.00 -1.03 0.00 0.00 54.13 54.03 1ce8 s LEU 13 Cb -0.15 -3.27 -0.03 0.00 0.03 0.00 0.00 46.19 42.78 1ce8 s LEU 13 CO 0.02 -0.62 1.03 -0.83 0.23 0.00 0.00 176.35 176.18 1ce8 s GLY 14 N 1.44 1.64 0.26 -3.19 0.00 0.12 -3.51 107.32 104.09 1ce8 s GLY 14 Ca 0.37 -0.18 0.14 0.00 0.00 0.00 0.00 44.72 45.05 1ce8 s GLY 14 CO 0.10 0.11 1.49 0.00 0.00 0.00 0.00 173.10 174.80 1ce8 h ALA 15 N -0.37 0.70 0.00 3.20 0.00 -1.82 -3.38 119.26 117.59 1ce8 h ALA 15 Ca -0.44 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 53.92 1ce8 h ALA 15 Cb 1.21 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1ce8 h ALA 15 CO 0.62 0.75 0.00 0.41 0.00 0.00 0.00 179.25 181.03 1ce8 n GLY 16 N 0.93 -1.79 3.75 0.00 0.00 -1.26 -4.73 105.19 102.09 1ce8 n GLY 16 Ca 0.01 -1.80 -0.38 0.00 0.00 0.00 0.00 46.02 43.84 1ce8 n GLY 16 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ce8 s PRO 17 N 0.00 3.08 0.05 1.61 0.04 -1.26 -4.49 135.00 134.02 1ce8 s PRO 17 Ca 0.00 2.26 -0.31 0.00 0.04 0.00 0.00 61.00 63.00 1ce8 s PRO 17 Cb 0.00 -2.23 -0.06 0.00 0.04 0.00 0.00 34.50 32.25 1ce8 s PRO 17 CO 0.00 -1.25 1.33 0.42 0.04 0.00 0.00 177.00 177.54 1ce8 s ILE 18 N -1.29 3.70 0.22 0.56 -1.09 -1.26 -4.91 121.20 117.14 1ce8 s ILE 18 Ca 0.72 1.17 0.01 0.00 -2.23 0.00 0.00 60.65 60.32 1ce8 s ILE 18 Cb -0.41 -3.75 -0.05 0.00 -1.58 0.00 0.00 42.46 36.67 1ce8 s ILE 18 CO 0.48 0.05 0.09 0.68 -1.23 0.00 0.00 174.94 175.02 1ce8 s VAL 19 N 1.62 0.38 0.14 2.92 -7.23 -0.44 -1.70 120.40 116.08 1ce8 s VAL 19 Ca 0.62 -1.99 -0.31 0.00 -1.81 0.00 0.00 61.98 58.49 1ce8 s VAL 19 Cb -0.32 -2.51 -0.09 0.00 0.56 0.00 0.00 36.38 34.02 1ce8 s VAL 19 CO 0.28 -0.08 1.58 -0.63 -0.31 0.00 0.00 175.10 175.94 1ce8 s ILE 20 N -3.88 2.77 0.00 -0.62 1.01 -1.26 -1.44 121.20 117.78 1ce8 s ILE 20 Ca 0.36 0.49 0.00 0.00 0.00 0.00 0.00 60.65 61.50 1ce8 s ILE 20 Cb 0.07 -3.31 0.00 0.00 0.01 0.00 0.00 42.46 39.23 1ce8 s ILE 20 CO 0.11 0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.69 1ce8 n GLY 21 N 3.79 2.34 2.69 6.18 0.00 -1.26 -4.91 105.19 114.03 1ce8 n GLY 21 Ca 0.14 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.01 1ce8 n GLY 21 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ce8 s GLN 22 N -0.69 0.82 0.00 1.61 0.74 -0.52 -4.70 119.66 116.92 1ce8 s GLN 22 Ca 0.00 -1.20 0.00 0.00 0.05 0.00 0.00 55.36 54.21 1ce8 s GLN 22 Cb 0.00 -0.70 0.00 0.00 1.10 0.00 0.00 33.01 33.41 1ce8 s GLN 22 CO 0.00 -1.28 0.00 0.00 -0.55 0.00 0.00 175.29 173.46 1ce8 n ALA 23 N 3.59 0.00 0.21 1.58 0.00 -1.24 -1.33 120.51 123.31 1ce8 n ALA 23 Ca 0.18 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.78 1ce8 n ALA 23 Cb 0.49 0.00 0.81 0.00 0.00 0.00 0.00 19.45 20.75 1ce8 n ALA 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ce8 h GLU 25 N 0.00 0.30 0.00 0.00 9.09 -1.81 0.47 114.58 122.62 1ce8 h GLU 25 Ca 0.08 -0.02 0.00 0.00 0.05 0.00 0.00 59.36 59.47 1ce8 h GLU 25 Cb 0.42 -0.07 0.00 0.00 -1.65 0.00 0.00 28.75 27.45 1ce8 h GLU 25 CO -0.00 0.20 0.00 1.19 0.05 0.00 0.00 179.01 180.44 1ce8 n PHE 26 N -4.50 0.16 -0.02 2.06 3.72 -1.03 -1.26 117.46 116.59 1ce8 n PHE 26 Ca 0.23 0.05 -0.21 0.00 -0.05 0.00 0.00 57.45 57.47 1ce8 n PHE 26 Cb 0.90 -0.58 -0.13 0.00 -0.94 0.00 0.00 39.48 38.73 1ce8 n PHE 26 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 176.76 176.93 1ce8 h ASP 27 N 0.00 0.29 -0.22 4.37 3.58 -0.30 -2.22 116.42 121.92 1ce8 h ASP 27 Ca 0.00 -0.80 0.05 0.00 0.42 0.00 0.00 57.03 56.70 1ce8 h ASP 27 Cb 0.49 -0.09 -0.05 0.00 1.72 0.00 0.00 39.33 41.39 1ce8 h ASP 27 CO 0.00 1.65 -0.10 0.22 -2.88 0.00 0.00 179.24 178.13 1ce8 h TYR 28 N -0.39 -0.23 -0.04 0.28 3.20 -1.15 0.30 116.97 118.94 1ce8 h TYR 28 Ca -0.35 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.54 1ce8 h TYR 28 Cb 1.71 0.14 -0.00 0.00 1.54 0.00 0.00 36.73 40.12 1ce8 h TYR 28 CO 0.11 -0.15 -0.02 0.77 -1.64 0.00 0.00 178.16 177.23 1ce8 h SER 29 N -0.07 0.08 -0.82 -2.11 0.02 -1.32 -2.20 113.55 107.14 1ce8 h SER 29 Ca 0.12 -0.40 0.03 0.00 -0.84 0.00 0.00 61.79 60.70 1ce8 h SER 29 Cb 0.24 -0.02 -0.05 0.00 0.14 0.00 0.00 62.40 62.71 1ce8 h SER 29 CO -0.26 0.46 0.54 1.23 -1.14 0.00 0.00 176.83 177.66 1ce8 h GLY 30 N -0.29 1.15 1.00 -3.77 0.00 -1.25 -0.43 103.07 99.48 1ce8 h GLY 30 Ca 0.01 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 1ce8 h GLY 30 CO 0.01 0.36 -0.10 0.00 0.00 0.00 0.00 176.54 176.80 1ce8 h ALA 31 N 1.52 -0.27 -0.72 3.60 0.00 -0.28 -1.89 119.26 121.22 1ce8 h ALA 31 Ca 0.32 -0.06 0.12 0.00 0.00 0.00 0.00 54.91 55.30 1ce8 h ALA 31 Cb 0.01 0.10 -0.09 0.00 0.00 0.00 0.00 17.79 17.82 1ce8 h ALA 31 CO -0.09 -0.65 0.29 1.96 0.00 0.00 0.00 179.25 180.76 1ce8 h GLN 32 N -0.27 0.44 -0.18 0.00 4.20 -0.68 -1.41 115.11 117.21 1ce8 h GLN 32 Ca -0.03 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 1ce8 h GLN 32 Cb 0.21 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 1ce8 h GLN 32 CO 0.05 0.29 0.06 0.00 -0.67 0.00 0.00 178.83 178.56 1ce8 h ALA 33 N 1.50 0.24 0.14 3.87 0.00 -0.92 0.17 119.26 124.26 1ce8 h ALA 33 Ca 0.38 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.19 1ce8 h ALA 33 Cb 0.54 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1ce8 h ALA 33 CO -0.37 -0.15 -0.41 0.00 0.00 0.00 0.00 179.25 178.32 1ce8 h LYS 35 N -0.65 0.26 0.31 0.00 3.64 -1.24 0.55 116.57 119.44 1ce8 h LYS 35 Ca 0.02 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1ce8 h LYS 35 Cb 0.67 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.43 1ce8 h LYS 35 CO -0.23 0.17 -0.17 0.00 -2.27 0.00 0.00 179.45 176.95 1ce8 h ALA 36 N 1.30 -0.44 -0.39 5.00 0.00 -0.23 -0.89 119.26 123.61 1ce8 h ALA 36 Ca 0.20 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1ce8 h ALA 36 Cb 0.22 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1ce8 h ALA 36 CO -0.24 -0.76 0.26 -0.07 0.00 0.00 0.00 179.25 178.45 1ce8 h LEU 37 N -0.45 0.43 -0.25 0.00 3.38 -0.24 -1.38 115.31 116.80 1ce8 h LEU 37 Ca -0.04 -0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.74 1ce8 h LEU 37 Cb 0.36 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1ce8 h LEU 37 CO 0.05 0.31 -0.54 -0.09 0.09 0.00 0.00 178.44 178.27 1ce8 h ARG 38 N 0.51 0.81 -0.21 1.13 2.43 0.42 -0.62 114.38 118.86 1ce8 h ARG 38 Ca 0.14 -0.53 0.01 0.00 -0.81 0.00 0.00 59.98 58.79 1ce8 h ARG 38 Cb -0.03 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 1ce8 h ARG 38 CO -0.03 1.16 0.11 0.93 -1.51 0.00 0.00 179.97 180.63 1ce8 h GLU 39 N 0.57 0.22 0.00 0.20 5.08 -0.63 -0.50 114.58 119.52 1ce8 h GLU 39 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1ce8 h GLU 39 Cb 1.15 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1ce8 h GLU 39 CO 0.12 0.15 0.00 0.39 -1.00 0.00 0.00 179.01 178.67 1ce8 n GLU 40 N -4.99 0.15 -2.36 2.33 -0.58 -0.57 -4.88 120.64 109.75 1ce8 n GLU 40 Ca -0.03 0.18 -0.11 0.00 -0.42 0.00 0.00 57.16 56.78 1ce8 n GLU 40 Cb 0.05 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.42 1ce8 n GLU 40 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ce8 n GLY 41 N -0.51 -0.02 3.92 0.62 0.00 -0.20 -5.06 105.19 103.94 1ce8 n GLY 41 Ca 0.05 -0.40 -0.26 0.00 0.00 0.00 0.00 46.02 45.41 1ce8 n GLY 41 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ce8 s TYR 42 N -2.64 3.50 -0.35 1.61 2.02 -0.28 -5.01 117.35 116.19 1ce8 s TYR 42 Ca 0.05 0.66 -0.20 0.00 -0.37 0.00 0.00 57.07 57.21 1ce8 s TYR 42 Cb -0.02 -2.26 0.00 0.00 -0.40 0.00 0.00 41.96 39.28 1ce8 s TYR 42 CO 0.07 -0.25 0.64 0.50 -1.57 0.00 0.00 175.55 174.93 1ce8 s ARG 43 N -4.67 3.69 -0.37 -0.62 3.52 0.02 -4.62 118.95 115.90 1ce8 s ARG 43 Ca 0.47 0.08 -0.14 0.00 -0.13 0.00 0.00 55.73 56.00 1ce8 s ARG 43 Cb -0.10 -3.80 0.00 0.00 -1.56 0.00 0.00 34.95 29.49 1ce8 s ARG 43 CO 0.43 -0.73 0.30 0.08 -0.81 0.00 0.00 175.30 174.56 1ce8 s VAL 44 N 2.71 5.24 -0.14 7.11 1.01 -1.26 0.16 120.40 135.24 1ce8 s VAL 44 Ca 0.25 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 61.85 1ce8 s VAL 44 Cb -0.14 -3.84 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 1ce8 s VAL 44 CO 0.15 -0.17 -0.07 -0.63 0.00 0.00 0.00 175.10 174.37 1ce8 s ILE 45 N 1.79 3.61 0.03 2.22 1.01 -0.05 -0.39 121.20 129.42 1ce8 s ILE 45 Ca 0.07 -0.47 0.00 0.00 0.00 0.00 0.00 60.65 60.25 1ce8 s ILE 45 Cb -0.18 -2.55 -0.02 0.00 0.01 0.00 0.00 42.46 39.72 1ce8 s ILE 45 CO 0.11 0.51 -0.04 0.54 0.00 0.00 0.00 174.94 176.07 1ce8 s ASN 46 N 0.24 0.37 -0.11 3.58 4.22 -0.28 -0.36 114.94 122.60 1ce8 s ASN 46 Ca -0.05 -0.61 0.03 0.00 -2.14 0.00 0.00 52.86 50.09 1ce8 s ASN 46 Cb -0.14 0.11 0.01 0.00 1.28 0.00 0.00 41.25 42.51 1ce8 s ASN 46 CO 0.04 -0.35 -0.21 0.54 -2.04 0.00 0.00 177.10 175.08 1ce8 s VAL 47 N -1.98 1.88 -0.30 3.54 0.11 -0.73 -0.02 120.40 122.91 1ce8 s VAL 47 Ca -0.10 -0.90 -0.03 0.00 -2.93 0.00 0.00 61.98 58.02 1ce8 s VAL 47 Cb -0.06 -1.65 0.18 0.00 -1.53 0.00 0.00 36.38 33.31 1ce8 s VAL 47 CO -0.03 0.52 0.61 0.21 -3.33 0.00 0.00 175.10 173.08 1ce8 s ASN 48 N 0.61 -1.32 0.39 3.54 3.84 0.18 0.14 114.94 122.32 1ce8 s ASN 48 Ca -0.13 1.00 0.28 0.00 0.21 0.00 0.00 52.86 54.22 1ce8 s ASN 48 Cb -0.17 2.18 1.28 0.00 -0.55 0.00 0.00 41.25 44.00 1ce8 s ASN 48 CO 0.04 -0.25 1.85 0.77 -2.79 0.00 0.00 177.10 176.71 1ce8 h SER 49 N 8.00 0.00 -3.63 -4.21 4.64 -1.72 -3.35 113.55 113.28 1ce8 h SER 49 Ca -0.22 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.48 1ce8 h SER 49 Cb 1.15 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.11 1ce8 h SER 49 CO 0.23 0.00 0.38 0.21 -0.87 0.00 0.00 176.83 176.78 1ce8 s ASN 50 N -4.67 6.42 0.39 4.97 2.47 -1.26 -1.64 114.94 121.62 1ce8 s ASN 50 Ca 0.01 -0.07 0.20 0.00 0.42 0.00 0.00 52.86 53.42 1ce8 s ASN 50 Cb 0.09 -2.39 0.69 0.00 -1.45 0.00 0.00 41.25 38.19 1ce8 s ASN 50 CO 0.39 -0.93 1.73 1.55 -3.72 0.00 0.00 177.10 176.13 1ce8 h PRO 51 N 8.98 0.00 -1.86 0.43 0.13 -1.81 -3.29 132.00 134.58 1ce8 h PRO 51 Ca -0.25 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.75 1ce8 h PRO 51 Cb 1.08 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.16 1ce8 h PRO 51 CO 0.97 0.33 0.11 0.00 -0.23 0.00 0.00 178.00 179.17 1ce8 n ALA 52 N -2.26 4.61 -2.42 -0.56 0.00 -1.26 -4.65 120.51 113.98 1ce8 n ALA 52 Ca 0.00 -0.75 -0.29 0.00 0.00 0.00 0.00 53.44 52.39 1ce8 n ALA 52 Cb 0.51 -1.26 -0.13 0.00 0.00 0.00 0.00 19.45 18.57 1ce8 n ALA 52 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1ce8 s THR 53 N -0.70 2.45 0.13 0.00 -4.23 -1.24 -4.67 115.64 107.38 1ce8 s THR 53 Ca 0.17 -1.56 -0.05 0.00 -1.18 0.00 0.00 61.69 59.07 1ce8 s THR 53 Cb 0.11 -2.07 -0.18 0.00 1.34 0.00 0.00 72.50 71.71 1ce8 s THR 53 CO -0.01 0.17 1.31 0.40 -0.54 0.00 0.00 174.62 175.95 1ce8 h ILE 54 N 3.86 1.39 0.00 2.99 1.08 -1.90 -2.96 117.51 121.97 1ce8 h ILE 54 Ca -0.50 -2.40 0.00 0.00 -0.39 0.00 0.00 64.86 61.58 1ce8 h ILE 54 Cb 1.16 2.38 0.00 0.00 -3.07 0.00 0.00 36.82 37.29 1ce8 h ILE 54 CO 0.43 0.72 0.00 0.00 -0.69 0.00 0.00 178.15 178.60 1ce8 h MET 55 N 0.25 0.00 -0.62 2.37 -0.00 -1.92 0.40 114.93 115.42 1ce8 h MET 55 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.62 1ce8 h MET 55 Cb 1.56 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 33.16 1ce8 h MET 55 CO 0.16 0.00 0.00 0.25 -0.00 0.00 0.00 176.91 177.32 1ce8 n THR 56 N -2.78 1.35 -2.93 -0.10 -2.24 -1.12 -4.76 114.28 101.70 1ce8 n THR 56 Ca -0.02 -0.88 -0.42 0.00 -2.27 0.00 0.00 64.05 60.47 1ce8 n THR 56 Cb 0.11 0.04 -0.05 0.00 -2.10 0.00 0.00 70.33 68.33 1ce8 n THR 56 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1ce8 s ASP 57 N -0.80 6.77 0.30 3.42 1.01 0.14 -4.94 116.67 122.58 1ce8 s ASP 57 Ca 0.38 0.94 0.14 0.00 0.71 0.00 0.00 52.55 54.72 1ce8 s ASP 57 Cb 0.25 -2.42 1.03 0.00 1.01 0.00 0.00 42.92 42.79 1ce8 s ASP 57 CO 0.19 -0.51 1.35 -0.81 0.21 0.00 0.00 175.17 175.60 1ce8 n PRO 58 N 5.99 -0.06 0.00 8.23 -0.04 -1.26 0.20 135.00 148.06 1ce8 n PRO 58 Ca 0.04 1.20 0.08 0.00 -0.04 0.00 0.00 63.50 64.78 1ce8 n PRO 58 Cb 0.48 -2.10 0.46 0.00 -0.04 0.00 0.00 33.50 32.30 1ce8 n PRO 58 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1ce8 n GLU 59 N -5.00 0.97 -0.00 0.54 0.00 -1.26 -3.05 120.64 112.84 1ce8 n GLU 59 Ca 0.29 0.00 0.09 0.00 0.00 0.00 0.00 57.16 57.55 1ce8 n GLU 59 Cb 0.99 -1.25 -0.12 0.00 0.00 0.00 0.00 31.44 31.06 1ce8 n GLU 59 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1ce8 n MET 60 N -0.75 0.72 -4.00 3.44 2.81 0.54 -5.00 117.12 114.87 1ce8 n MET 60 Ca 0.12 -0.05 -0.09 0.00 -1.81 0.00 0.00 57.70 55.86 1ce8 n MET 60 Cb 0.05 -1.41 -0.05 0.00 -0.71 0.00 0.00 33.22 31.10 1ce8 n MET 60 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1ce8 s ALA 61 N -2.95 -0.20 -0.15 3.04 0.00 -1.17 -4.52 121.76 115.80 1ce8 s ALA 61 Ca 0.03 -0.91 -0.25 0.00 0.00 0.00 0.00 51.96 50.83 1ce8 s ALA 61 Cb 0.14 1.06 -0.22 0.00 0.00 0.00 0.00 23.12 24.09 1ce8 s ALA 61 CO 0.78 -0.86 0.57 -0.44 0.00 0.00 0.00 175.76 175.82 1ce8 h ASP 62 N 2.23 0.00 -3.56 0.00 3.32 -0.96 -3.43 116.42 114.02 1ce8 h ASP 62 Ca -0.26 -0.80 -0.61 0.00 0.02 0.00 0.00 57.03 55.37 1ce8 h ASP 62 Cb 1.25 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 40.40 1ce8 h ASP 62 CO 0.35 1.09 -0.73 0.00 -1.72 0.00 0.00 179.24 178.24 1ce8 s ALA 63 N -2.28 2.24 -0.41 3.45 0.00 -0.76 -4.85 121.76 119.15 1ce8 s ALA 63 Ca -0.20 -2.47 -0.22 0.00 0.00 0.00 0.00 51.96 49.07 1ce8 s ALA 63 Cb -0.01 -1.87 0.02 0.00 0.00 0.00 0.00 23.12 21.26 1ce8 s ALA 63 CO 0.62 -1.93 0.70 0.99 0.00 0.00 0.00 175.76 176.14 1ce8 s THR 64 N 0.62 4.78 -0.46 0.00 2.01 -1.26 -1.13 115.64 120.20 1ce8 s THR 64 Ca 0.15 0.43 -0.12 0.00 0.31 0.00 0.00 61.69 62.46 1ce8 s THR 64 Cb -0.23 -4.21 0.09 0.00 0.01 0.00 0.00 72.50 68.17 1ce8 s THR 64 CO -0.06 -0.54 0.34 -0.31 -0.69 0.00 0.00 174.62 173.36 1ce8 s TYR 65 N 2.97 3.31 -1.12 4.92 1.51 0.97 0.15 117.35 130.06 1ce8 s TYR 65 Ca 0.26 -1.38 -0.13 0.00 -1.01 0.00 0.00 57.07 54.82 1ce8 s TYR 65 Cb -0.13 -3.19 0.20 0.00 -0.11 0.00 0.00 41.96 38.73 1ce8 s TYR 65 CO 0.19 -0.87 1.25 0.42 -1.11 0.00 0.00 175.55 175.43 1ce8 s ILE 66 N 1.50 5.35 0.20 2.71 1.01 -1.26 -0.65 121.20 130.06 1ce8 s ILE 66 Ca 0.04 -2.76 0.01 0.00 0.00 0.00 0.00 60.65 57.94 1ce8 s ILE 66 Cb -0.25 -4.77 -0.05 0.00 0.01 0.00 0.00 42.46 37.40 1ce8 s ILE 66 CO 0.03 -1.43 0.04 -1.61 0.00 0.00 0.00 174.94 171.97 1ce8 s GLU 67 N 0.71 1.21 0.24 2.79 0.41 -1.26 -4.65 118.70 118.15 1ce8 s GLU 67 Ca 0.36 -1.62 -0.30 0.00 -0.41 0.00 0.00 54.97 53.00 1ce8 s GLU 67 Cb -0.06 -0.22 -0.10 0.00 -1.78 0.00 0.00 34.13 31.97 1ce8 s GLU 67 CO -0.04 -0.21 1.52 -2.14 -0.49 0.00 0.00 175.26 173.90 1ce8 s PRO 68 N -3.97 4.21 -1.42 0.39 0.01 -1.26 -2.67 135.00 130.29 1ce8 s PRO 68 Ca 0.30 2.39 -0.14 0.00 0.01 0.00 0.00 61.00 63.55 1ce8 s PRO 68 Cb 0.07 -3.10 0.03 0.00 0.01 0.00 0.00 34.50 31.51 1ce8 s PRO 68 CO 0.08 -0.53 2.21 -0.89 0.01 0.00 0.00 177.00 177.88 1ce8 n ILE 69 N 2.72 3.37 -5.08 2.83 5.41 -1.26 -4.68 119.36 122.66 1ce8 n ILE 69 Ca 0.09 -2.95 -0.32 0.00 1.00 0.00 0.00 62.75 60.57 1ce8 n ILE 69 Cb 0.39 -2.59 -0.15 0.00 -0.71 0.00 0.00 39.64 36.58 1ce8 n ILE 69 CO 0.00 0.00 0.00 -2.28 0.00 0.00 0.00 176.55 174.27 1ce8 s HIS 70 N 3.32 2.57 0.34 1.39 2.46 -1.26 -5.01 115.29 119.10 1ce8 s HIS 70 Ca 0.48 -0.59 0.14 0.00 0.47 0.00 0.00 55.06 55.56 1ce8 s HIS 70 Cb 0.14 -1.66 1.07 0.00 -0.13 0.00 0.00 32.58 32.00 1ce8 s HIS 70 CO -0.08 -0.13 1.65 0.11 -2.47 0.00 0.00 174.74 173.83 1ce8 h TRP 71 N 6.04 0.84 -0.65 3.88 5.08 -1.91 0.42 115.95 129.64 1ce8 h TRP 71 Ca -0.34 0.04 -0.07 0.00 1.08 0.00 0.00 58.89 59.61 1ce8 h TRP 71 Cb 1.18 -0.21 -0.03 0.00 -3.00 0.00 0.00 29.16 27.11 1ce8 h TRP 71 CO 0.46 -0.22 0.14 0.93 -1.28 0.00 0.00 178.44 178.47 1ce8 h GLU 72 N 0.27 1.04 -0.35 0.12 5.08 -1.96 0.10 114.58 118.90 1ce8 h GLU 72 Ca 0.72 -0.25 -0.16 0.00 -1.00 0.00 0.00 59.36 58.67 1ce8 h GLU 72 Cb 1.66 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.77 1ce8 h GLU 72 CO -0.63 0.94 -0.42 0.28 -1.00 0.00 0.00 179.01 178.17 1ce8 h VAL 73 N 0.99 1.28 -0.28 3.13 2.07 -0.52 -2.40 116.25 120.51 1ce8 h VAL 73 Ca 0.21 -1.60 -0.04 0.00 0.82 0.00 0.00 66.70 66.08 1ce8 h VAL 73 Cb 0.37 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 1ce8 h VAL 73 CO 0.00 0.53 0.01 0.58 0.02 0.00 0.00 177.57 178.71 1ce8 h VAL 74 N 0.71 1.25 -0.73 2.57 2.07 -0.90 -2.00 116.25 119.23 1ce8 h VAL 74 Ca 0.05 -0.90 0.16 0.00 0.82 0.00 0.00 66.70 66.83 1ce8 h VAL 74 Cb 1.01 1.30 -0.13 0.00 -1.52 0.00 0.00 31.29 31.95 1ce8 h VAL 74 CO 0.10 0.29 -0.02 -0.09 0.02 0.00 0.00 177.57 177.87 1ce8 h ARG 75 N 0.28 0.09 -0.54 1.57 2.43 -0.77 1.76 114.38 119.20 1ce8 h ARG 75 Ca 0.08 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.27 1ce8 h ARG 75 Cb 0.41 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 1ce8 h ARG 75 CO 0.01 0.06 0.36 0.87 -1.51 0.00 0.00 179.97 179.76 1ce8 h LYS 76 N 0.09 0.64 -0.04 0.20 1.79 -1.13 0.33 116.57 118.45 1ce8 h LYS 76 Ca 0.39 -0.04 -0.22 0.00 -2.18 0.00 0.00 60.65 58.60 1ce8 h LYS 76 Cb 0.67 -0.14 0.01 0.00 -1.58 0.00 0.00 32.23 31.18 1ce8 h LYS 76 CO -0.65 0.42 -0.89 0.82 -1.08 0.00 0.00 179.45 178.08 1ce8 h ILE 77 N 0.66 1.36 0.08 1.86 2.04 0.31 -3.03 117.51 120.79 1ce8 h ILE 77 Ca 0.21 -2.28 -0.00 0.00 1.00 0.00 0.00 64.86 63.79 1ce8 h ILE 77 Cb 0.03 2.28 0.00 0.00 -0.74 0.00 0.00 36.82 38.39 1ce8 h ILE 77 CO -0.05 0.69 -0.04 0.40 0.00 0.00 0.00 178.15 179.15 1ce8 h ILE 78 N 0.31 1.12 -0.88 -0.67 2.04 0.15 0.15 117.51 119.73 1ce8 h ILE 78 Ca -0.07 -0.75 0.14 0.00 1.00 0.00 0.00 64.86 65.18 1ce8 h ILE 78 Cb 1.51 1.60 -0.09 0.00 -0.74 0.00 0.00 36.82 39.10 1ce8 h ILE 78 CO 0.16 0.18 0.49 -0.08 0.00 0.00 0.00 178.15 178.90 1ce8 h GLU 79 N -0.45 0.69 0.01 2.37 4.22 -0.50 0.63 114.58 121.55 1ce8 h GLU 79 Ca -0.01 -0.04 -0.23 0.00 0.08 0.00 0.00 59.36 59.15 1ce8 h GLU 79 Cb 0.39 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1ce8 h GLU 79 CO 0.02 0.46 -1.18 -0.22 -2.18 0.00 0.00 179.01 175.91 1ce8 h LYS 80 N 0.71 0.02 0.00 1.92 3.64 -1.48 -3.36 116.57 118.03 1ce8 h LYS 80 Ca 0.47 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.81 1ce8 h LYS 80 Cb 0.61 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1ce8 h LYS 80 CO -0.33 0.91 -1.68 0.39 -2.27 0.00 0.00 179.45 176.47 1ce8 n GLU 81 N -3.30 0.51 -3.60 1.90 -0.58 0.51 -5.01 120.64 111.06 1ce8 n GLU 81 Ca -0.04 -0.13 -0.27 0.00 -0.42 0.00 0.00 57.16 56.30 1ce8 n GLU 81 Cb 0.97 -1.54 0.01 0.00 -0.57 0.00 0.00 31.44 30.31 1ce8 n GLU 81 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1ce8 n ARG 82 N -2.12 -1.52 -2.83 3.49 5.12 0.21 -4.91 116.66 114.11 1ce8 n ARG 82 Ca -0.02 0.84 -0.37 0.00 -1.93 0.00 0.00 57.85 56.37 1ce8 n ARG 82 Cb 0.51 -1.98 -0.06 0.00 -1.16 0.00 0.00 32.46 29.77 1ce8 n ARG 82 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1ce8 s PRO 83 N -4.09 4.58 -0.02 5.56 0.04 -1.26 -4.90 135.00 134.91 1ce8 s PRO 83 Ca 0.09 1.28 -0.24 0.00 0.04 0.00 0.00 61.00 62.18 1ce8 s PRO 83 Cb -0.01 -2.90 -0.18 0.00 0.04 0.00 0.00 34.50 31.45 1ce8 s PRO 83 CO 0.82 0.34 1.14 -0.44 0.04 0.00 0.00 177.00 178.90 1ce8 h ASP 84 N 3.39 -0.14 -3.26 6.66 3.32 -0.76 -3.42 116.42 122.22 1ce8 h ASP 84 Ca -0.47 -0.38 -0.46 0.00 0.02 0.00 0.00 57.03 55.75 1ce8 h ASP 84 Cb 1.19 0.04 -0.14 0.00 0.22 0.00 0.00 39.33 40.64 1ce8 h ASP 84 CO 0.65 0.34 -0.65 0.00 -1.72 0.00 0.00 179.24 177.87 1ce8 s ALA 85 N -4.21 2.21 -0.05 3.45 0.00 -0.19 -1.56 121.76 121.41 1ce8 s ALA 85 Ca -0.15 -1.91 0.02 0.00 0.00 0.00 0.00 51.96 49.92 1ce8 s ALA 85 Cb 0.01 0.39 0.01 0.00 0.00 0.00 0.00 23.12 23.54 1ce8 s ALA 85 CO 0.58 -0.18 -0.09 0.54 0.00 0.00 0.00 175.76 176.61 1ce8 s VAL 86 N -3.20 0.88 -0.45 0.00 0.11 0.29 0.67 120.40 118.71 1ce8 s VAL 86 Ca 0.31 -0.35 -0.09 0.00 -2.93 0.00 0.00 61.98 58.93 1ce8 s VAL 86 Cb 0.06 -0.82 0.10 0.00 -1.53 0.00 0.00 36.38 34.19 1ce8 s VAL 86 CO 0.12 0.29 0.30 -0.22 -3.33 0.00 0.00 175.10 172.26 1ce8 s LEU 87 N 0.62 5.46 0.00 2.54 2.96 0.18 -0.84 118.68 129.60 1ce8 s LEU 87 Ca -0.11 -1.78 0.24 0.00 -0.22 0.00 0.00 54.13 52.27 1ce8 s LEU 87 Cb -0.14 -1.99 0.48 0.00 0.50 0.00 0.00 46.19 45.04 1ce8 s LEU 87 CO 0.02 -0.62 1.42 -0.81 -1.32 0.00 0.00 176.35 175.04 1ce8 n PRO 88 N 4.88 2.17 -0.11 0.98 -0.04 -1.26 -2.63 135.00 139.00 1ce8 n PRO 88 Ca -0.08 -1.72 0.06 0.00 -0.04 0.00 0.00 63.50 61.71 1ce8 n PRO 88 Cb 0.42 -1.47 0.20 0.00 -0.04 0.00 0.00 33.50 32.60 1ce8 n PRO 88 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1ce8 n THR 89 N 1.03 0.28 -0.86 0.52 -2.24 -1.26 -4.00 114.28 107.75 1ce8 n THR 89 Ca 0.16 -0.31 0.08 0.00 -2.27 0.00 0.00 64.05 61.72 1ce8 n THR 89 Cb 0.52 0.17 0.16 0.00 -2.10 0.00 0.00 70.33 69.08 1ce8 n THR 89 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1ce8 n MET 90 N 0.16 2.06 -2.70 -0.78 2.81 -1.26 -2.13 117.12 115.27 1ce8 n MET 90 Ca 0.10 -2.49 -0.07 0.00 -1.81 0.00 0.00 57.70 53.43 1ce8 n MET 90 Cb 0.22 -1.52 0.05 0.00 -0.71 0.00 0.00 33.22 31.25 1ce8 n MET 90 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ce8 n GLY 91 N -0.94 1.56 7.00 3.03 0.00 -1.23 -4.24 105.19 110.37 1ce8 n GLY 91 Ca 0.15 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 45.07 1ce8 n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ce8 n GLY 92 N -0.26 1.00 0.28 -0.02 0.00 -1.26 -1.33 105.19 103.60 1ce8 n GLY 92 Ca 0.07 -0.61 -0.10 0.00 0.00 0.00 0.00 46.02 45.38 1ce8 n GLY 92 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1ce8 h GLN 93 N 0.00 0.95 -0.29 1.61 5.75 -1.96 -2.39 115.11 118.79 1ce8 h GLN 93 Ca 0.00 -0.31 0.06 0.00 -0.15 0.00 0.00 58.65 58.26 1ce8 h GLN 93 Cb 0.00 -0.08 -0.08 0.00 1.07 0.00 0.00 27.48 28.39 1ce8 h GLN 93 CO 0.00 0.97 -0.35 1.15 -2.65 0.00 0.00 178.83 177.95 1ce8 h THR 94 N 0.83 0.22 -0.84 2.39 2.02 -1.85 0.98 112.91 116.67 1ce8 h THR 94 Ca 0.15 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.36 1ce8 h THR 94 Cb 0.55 0.22 -0.05 0.00 -1.74 0.00 0.00 68.15 67.13 1ce8 h THR 94 CO 0.03 0.00 0.54 0.00 0.37 0.00 0.00 175.52 176.46 1ce8 h ALA 95 N 0.55 1.09 -0.43 6.16 0.00 -1.13 -0.44 119.26 125.07 1ce8 h ALA 95 Ca 0.14 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1ce8 h ALA 95 Cb 0.55 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1ce8 h ALA 95 CO -0.47 0.39 -0.00 -0.07 0.00 0.00 0.00 179.25 179.10 1ce8 h LEU 96 N 1.07 0.74 -0.16 0.00 3.38 -0.63 -2.54 115.31 117.18 1ce8 h LEU 96 Ca 0.33 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1ce8 h LEU 96 Cb -0.03 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1ce8 h LEU 96 CO -0.10 0.87 0.00 0.78 0.09 0.00 0.00 178.44 180.08 1ce8 h ASN 97 N 0.59 0.27 -0.39 -0.43 2.35 0.14 -2.59 115.58 115.53 1ce8 h ASN 97 Ca 0.12 -0.30 0.07 0.00 -0.55 0.00 0.00 56.30 55.63 1ce8 h ASN 97 Cb 0.49 -0.07 -0.06 0.00 0.05 0.00 0.00 38.32 38.73 1ce8 h ASN 97 CO 0.02 0.51 0.02 0.00 -1.65 0.00 0.00 177.43 176.33 1ce8 h ALA 99 N 1.33 0.81 0.00 0.00 0.00 -1.43 0.60 119.26 120.57 1ce8 h ALA 99 Ca 0.19 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 1ce8 h ALA 99 Cb 0.26 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1ce8 h ALA 99 CO -0.30 -0.22 -0.13 -0.07 0.00 0.00 0.00 179.25 178.53 1ce8 h LEU 100 N 0.38 0.00 0.03 0.00 4.07 -0.92 0.14 115.31 119.02 1ce8 h LEU 100 Ca 0.32 0.00 -0.27 0.00 0.08 0.00 0.00 57.88 58.01 1ce8 h LEU 100 Cb 0.43 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.19 1ce8 h LEU 100 CO -0.34 0.13 -1.16 -0.08 -1.08 0.00 0.00 178.44 175.91 1ce8 h GLU 101 N 0.00 0.50 -0.55 1.13 4.22 0.42 0.26 114.58 120.56 1ce8 h GLU 101 Ca -0.00 -0.65 0.00 0.00 0.08 0.00 0.00 59.36 58.78 1ce8 h GLU 101 Cb 0.86 0.21 -0.03 0.00 0.50 0.00 0.00 28.75 30.30 1ce8 h GLU 101 CO 0.02 1.27 0.34 -0.07 -2.18 0.00 0.00 179.01 178.39 1ce8 h LEU 102 N 0.23 0.65 0.48 1.64 3.38 0.46 0.75 115.31 122.90 1ce8 h LEU 102 Ca -0.15 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 1ce8 h LEU 102 Cb 1.83 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.42 1ce8 h LEU 102 CO 0.21 0.50 -0.23 -0.08 0.09 0.00 0.00 178.44 178.93 1ce8 h GLU 103 N 0.74 -0.62 -0.32 1.13 4.57 -0.85 -1.52 114.58 117.71 1ce8 h GLU 103 Ca 0.20 0.04 0.04 0.00 -1.18 0.00 0.00 59.36 58.46 1ce8 h GLU 103 Cb -0.04 0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.67 1ce8 h GLU 103 CO -0.04 -0.38 0.21 -0.09 -1.18 0.00 0.00 179.01 177.53 1ce8 h ARG 104 N -0.71 0.26 -0.03 1.92 2.43 -0.07 -1.56 114.38 116.62 1ce8 h ARG 104 Ca -0.07 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1ce8 h ARG 104 Cb 0.52 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 1ce8 h ARG 104 CO 0.11 0.17 0.00 1.04 -1.51 0.00 0.00 179.97 179.78 1ce8 n GLN 105 N -4.49 1.17 -0.98 0.20 1.13 0.26 -4.87 117.38 109.81 1ce8 n GLN 105 Ca 0.03 -0.26 0.00 0.00 -1.94 0.00 0.00 57.00 54.83 1ce8 n GLN 105 Cb 0.20 -1.35 0.00 0.00 0.11 0.00 0.00 30.24 29.20 1ce8 n GLN 105 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ce8 n GLY 106 N 0.90 0.56 0.27 1.08 0.00 -0.59 -4.91 105.19 102.51 1ce8 n GLY 106 Ca 0.16 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.15 1ce8 n GLY 106 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ce8 h VAL 107 N 0.00 1.23 -0.11 1.61 2.07 -1.46 -1.36 116.25 118.23 1ce8 h VAL 107 Ca 0.00 -0.99 -0.03 0.00 0.82 0.00 0.00 66.70 66.51 1ce8 h VAL 107 Cb 0.10 1.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1ce8 h VAL 107 CO 0.00 0.34 -0.03 -0.07 0.02 0.00 0.00 177.57 177.83 1ce8 h LEU 108 N 0.60 0.22 0.44 2.57 3.38 -1.81 -2.76 115.31 117.95 1ce8 h LEU 108 Ca 0.12 -0.37 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 1ce8 h LEU 108 Cb 0.46 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1ce8 h LEU 108 CO 0.02 0.54 -0.35 -0.08 0.09 0.00 0.00 178.44 178.66 1ce8 h GLU 109 N -0.10 -0.75 -1.17 1.13 4.81 -1.82 0.19 114.58 116.87 1ce8 h GLU 109 Ca 0.03 0.05 0.33 0.00 -0.13 0.00 0.00 59.36 59.64 1ce8 h GLU 109 Cb 0.44 0.17 -0.09 0.00 0.63 0.00 0.00 28.75 29.90 1ce8 h GLU 109 CO 0.01 -0.50 0.78 1.49 -0.73 0.00 0.00 179.01 180.06 1ce8 h GLU 110 N -0.78 0.20 -0.10 1.92 4.81 -1.29 -1.06 114.58 118.28 1ce8 h GLU 110 Ca -0.04 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1ce8 h GLU 110 Cb 0.68 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.01 1ce8 h GLU 110 CO -0.01 0.13 0.00 1.19 -0.73 0.00 0.00 179.01 179.59 1ce8 n PHE 111 N -4.50 0.14 -3.54 0.92 3.72 -1.04 -4.99 117.46 108.17 1ce8 n PHE 111 Ca 0.29 -0.47 -0.19 0.00 -0.05 0.00 0.00 57.45 57.02 1ce8 n PHE 111 Cb 1.14 -0.04 0.06 0.00 -0.94 0.00 0.00 39.48 39.70 1ce8 n PHE 111 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ce8 n GLY 112 N -0.16 -0.45 3.67 1.37 0.00 -0.02 -4.88 105.19 104.73 1ce8 n GLY 112 Ca 0.04 0.18 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 1ce8 n GLY 112 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ce8 s VAL 113 N -3.50 5.30 -0.15 1.61 1.01 0.48 -4.79 120.40 120.35 1ce8 s VAL 113 Ca 0.08 0.40 -0.10 0.00 0.00 0.00 0.00 61.98 62.36 1ce8 s VAL 113 Cb -0.02 -3.59 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 1ce8 s VAL 113 CO 0.77 0.32 0.18 -0.89 0.00 0.00 0.00 175.10 175.48 1ce8 s THR 114 N 1.07 5.40 -0.19 3.92 2.01 -0.60 -4.69 115.64 122.55 1ce8 s THR 114 Ca 0.12 0.30 -0.23 0.00 0.31 0.00 0.00 61.69 62.20 1ce8 s THR 114 Cb -0.14 -3.49 -0.02 0.00 0.01 0.00 0.00 72.50 68.87 1ce8 s THR 114 CO 0.05 0.51 0.71 -0.32 -0.69 0.00 0.00 174.62 174.89 1ce8 s MET 115 N -0.28 4.23 0.21 4.92 1.75 -1.26 0.10 119.30 128.97 1ce8 s MET 115 Ca 0.13 0.77 0.11 0.00 -1.25 0.00 0.00 55.69 55.46 1ce8 s MET 115 Cb -0.12 -3.59 -0.04 0.00 2.84 0.00 0.00 34.83 33.92 1ce8 s MET 115 CO 0.02 -0.30 -0.20 0.96 -0.65 0.00 0.00 175.02 174.85 1ce8 s ILE 116 N 2.09 2.56 0.00 10.11 -4.36 -0.02 -4.68 121.20 126.90 1ce8 s ILE 116 Ca 0.32 -2.03 0.00 0.00 -0.26 0.00 0.00 60.65 58.68 1ce8 s ILE 116 Cb -0.16 -2.26 0.00 0.00 1.25 0.00 0.00 42.46 41.29 1ce8 s ILE 116 CO 0.11 -0.17 0.00 0.61 0.24 0.00 0.00 174.94 175.72 1ce8 n GLY 117 N 0.04 2.53 3.41 6.27 0.00 -1.26 -3.98 105.19 112.19 1ce8 n GLY 117 Ca -0.11 -0.54 -0.13 0.00 0.00 0.00 0.00 46.02 45.24 1ce8 n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ce8 s ALA 118 N 0.00 -1.27 1.02 4.61 0.00 -1.26 -4.11 121.76 120.75 1ce8 s ALA 118 Ca 0.00 1.47 -0.12 0.00 0.00 0.00 0.00 51.96 53.31 1ce8 s ALA 118 Cb 0.00 -0.86 0.20 0.00 0.00 0.00 0.00 23.12 22.46 1ce8 s ALA 118 CO 0.00 -0.25 1.08 0.95 0.00 0.00 0.00 175.76 177.54 1ce8 s THR 119 N 0.35 2.20 0.11 0.00 -4.23 -1.26 -4.87 115.64 107.93 1ce8 s THR 119 Ca -0.01 0.06 0.17 0.00 -1.18 0.00 0.00 61.69 60.73 1ce8 s THR 119 Cb -0.04 -2.41 0.09 0.00 1.34 0.00 0.00 72.50 71.48 1ce8 s THR 119 CO -0.00 -0.08 1.64 0.00 -0.54 0.00 0.00 174.62 175.63 1ce8 h ALA 120 N -2.02 0.89 0.04 3.99 0.00 -1.99 -2.59 119.26 117.57 1ce8 h ALA 120 Ca -0.55 -0.42 -0.22 0.00 0.00 0.00 0.00 54.91 53.72 1ce8 h ALA 120 Cb 1.32 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1ce8 h ALA 120 CO 0.54 0.57 -1.00 0.22 0.00 0.00 0.00 179.25 179.58 1ce8 h ASP 121 N 0.00 0.33 -0.13 0.00 3.58 -1.96 -1.33 116.42 116.91 1ce8 h ASP 121 Ca -0.00 -0.30 -0.00 0.00 0.42 0.00 0.00 57.03 57.14 1ce8 h ASP 121 Cb 1.06 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 42.00 1ce8 h ASP 121 CO 0.06 1.15 0.07 0.00 -2.88 0.00 0.00 179.24 177.63 1ce8 h ALA 122 N 0.82 0.17 -0.20 -0.78 0.00 -1.72 0.40 119.26 117.95 1ce8 h ALA 122 Ca -0.07 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.81 1ce8 h ALA 122 Cb 1.67 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 19.36 1ce8 h ALA 122 CO 0.16 -0.28 -0.09 0.82 0.00 0.00 0.00 179.25 179.86 1ce8 h ILE 123 N 0.09 0.70 0.00 0.00 2.04 -1.45 -1.81 117.51 117.09 1ce8 h ILE 123 Ca 0.05 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.84 1ce8 h ILE 123 Cb 0.11 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1ce8 h ILE 123 CO -0.01 0.00 -0.33 -0.78 0.00 0.00 0.00 178.15 177.04 1ce8 h ASP 124 N -0.06 0.00 0.44 1.72 3.58 -0.94 -0.14 116.42 121.02 1ce8 h ASP 124 Ca 0.11 0.00 -0.09 0.00 0.42 0.00 0.00 57.03 57.47 1ce8 h ASP 124 Cb 0.23 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.27 1ce8 h ASP 124 CO -0.25 0.33 -0.41 0.50 -2.88 0.00 0.00 179.24 176.53 1ce8 h LYS 125 N 0.00 0.00 0.06 0.28 3.64 0.63 0.18 116.57 121.36 1ce8 h LYS 125 Ca -0.00 0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 59.03 1ce8 h LYS 125 Cb 0.61 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.39 1ce8 h LYS 125 CO 0.04 0.41 -1.99 0.00 -2.27 0.00 0.00 179.45 175.64 1ce8 n ALA 126 N -2.45 1.20 0.04 5.00 0.00 -0.92 -1.92 120.51 121.48 1ce8 n ALA 126 Ca -0.02 -0.77 -0.07 0.00 0.00 0.00 0.00 53.44 52.58 1ce8 n ALA 126 Cb 0.44 -0.63 -0.12 0.00 0.00 0.00 0.00 19.45 19.15 1ce8 n ALA 126 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1ce8 h GLU 127 N 0.03 0.00 -6.03 0.00 4.39 -0.97 -3.42 114.58 108.58 1ce8 h GLU 127 Ca -0.41 0.00 -0.59 0.00 0.34 0.00 0.00 59.36 58.71 1ce8 h GLU 127 Cb 2.03 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 30.61 1ce8 h GLU 127 CO 0.06 0.86 0.66 0.34 -1.16 0.00 0.00 179.01 179.77 1ce8 s ASP 128 N -6.55 6.89 0.36 1.42 -1.08 0.63 -1.55 116.67 116.80 1ce8 s ASP 128 Ca -0.00 1.04 0.07 0.00 -0.52 0.00 0.00 52.55 53.14 1ce8 s ASP 128 Cb 0.09 -2.49 0.70 0.00 -1.46 0.00 0.00 42.92 39.76 1ce8 s ASP 128 CO 0.82 -0.70 1.89 0.03 0.52 0.00 0.00 175.17 177.73 1ce8 h ARG 129 N 7.86 0.35 -0.18 4.34 2.47 -1.87 -0.29 114.38 127.06 1ce8 h ARG 129 Ca -0.21 -0.08 -0.01 0.00 -1.26 0.00 0.00 59.98 58.42 1ce8 h ARG 129 Cb 1.07 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 29.34 1ce8 h ARG 129 CO 0.96 0.45 0.07 -0.09 0.56 0.00 0.00 179.97 181.92 1ce8 h ARG 130 N 0.33 0.26 -0.61 0.04 2.43 -1.94 -0.13 114.38 114.77 1ce8 h ARG 130 Ca 0.07 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.14 1ce8 h ARG 130 Cb 0.38 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.86 1ce8 h ARG 130 CO 0.02 0.33 0.17 0.00 -1.51 0.00 0.00 179.97 178.99 1ce8 h ARG 131 N 0.13 0.95 -0.63 0.20 3.08 -1.77 -0.90 114.38 115.44 1ce8 h ARG 131 Ca 0.06 -0.21 -0.06 0.00 0.07 0.00 0.00 59.98 59.84 1ce8 h ARG 131 Cb 0.17 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 1ce8 h ARG 131 CO -0.00 0.86 0.17 0.35 -1.07 0.00 0.00 179.97 180.27 1ce8 h PHE 132 N 0.87 1.05 -0.83 3.04 3.57 -0.35 -0.62 116.94 123.66 1ce8 h PHE 132 Ca 0.19 -0.12 -0.04 0.00 3.53 0.00 0.00 57.97 61.54 1ce8 h PHE 132 Cb 0.31 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 38.72 1ce8 h PHE 132 CO 0.02 0.87 0.38 0.22 -2.23 0.00 0.00 178.31 177.56 1ce8 h ASP 133 N 0.92 1.11 -0.50 0.41 3.58 -0.71 -2.53 116.42 118.71 1ce8 h ASP 133 Ca 0.20 -0.15 -0.08 0.00 0.42 0.00 0.00 57.03 57.42 1ce8 h ASP 133 Cb 0.34 -0.29 -0.02 0.00 1.72 0.00 0.00 39.33 41.08 1ce8 h ASP 133 CO -0.00 0.95 0.04 0.58 -2.88 0.00 0.00 179.24 177.93 1ce8 h VAL 134 N 1.20 1.25 0.00 2.25 2.07 -0.87 -2.73 116.25 119.42 1ce8 h VAL 134 Ca 0.28 -1.02 -0.08 0.00 0.82 0.00 0.00 66.70 66.70 1ce8 h VAL 134 Cb 0.16 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 1ce8 h VAL 134 CO -0.03 0.37 -0.40 0.00 0.02 0.00 0.00 177.57 177.52 1ce8 h ALA 135 N 1.18 1.17 -0.14 1.67 0.00 -0.72 -2.46 119.26 119.95 1ce8 h ALA 135 Ca 0.17 -0.37 -0.22 0.00 0.00 0.00 0.00 54.91 54.49 1ce8 h ALA 135 Cb 0.45 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.18 1ce8 h ALA 135 CO 0.02 0.50 -0.78 0.52 0.00 0.00 0.00 179.25 179.51 1ce8 h MET 136 N 0.00 0.75 0.46 0.00 2.07 -1.20 -1.97 114.93 115.03 1ce8 h MET 136 Ca -0.00 -0.62 -0.02 0.00 -2.07 0.00 0.00 59.70 56.99 1ce8 h MET 136 Cb 0.80 0.13 -0.02 0.00 -1.87 0.00 0.00 31.60 30.64 1ce8 h MET 136 CO 0.05 1.23 -0.42 -0.22 1.07 0.00 0.00 176.91 178.62 1ce8 h LYS 137 N 0.51 -0.84 -0.97 1.72 3.64 -1.45 0.13 116.57 119.31 1ce8 h LYS 137 Ca -0.05 0.06 0.40 0.00 -1.27 0.00 0.00 60.65 59.78 1ce8 h LYS 137 Cb 1.40 0.19 -0.17 0.00 -0.41 0.00 0.00 32.23 33.24 1ce8 h LYS 137 CO 0.16 -0.56 0.49 1.17 -2.27 0.00 0.00 179.45 178.44 1ce8 n LYS 138 N -4.97 -0.06 -0.86 1.90 4.81 -0.93 0.07 118.16 118.12 1ce8 n LYS 138 Ca -0.10 1.34 0.02 0.00 -0.87 0.00 0.00 58.31 58.69 1ce8 n LYS 138 Cb 0.39 -2.39 0.33 0.00 0.02 0.00 0.00 35.03 33.38 1ce8 n LYS 138 CO 0.00 0.00 0.00 0.44 1.17 0.00 0.00 177.40 179.01 1ce8 n ILE 139 N -5.20 2.74 -0.98 3.15 -5.35 -0.73 -4.93 119.36 108.06 1ce8 n ILE 139 Ca 0.36 -1.67 0.00 0.00 -0.27 0.00 0.00 62.75 61.17 1ce8 n ILE 139 Cb 1.21 -0.31 0.00 0.00 -1.74 0.00 0.00 39.64 38.80 1ce8 n ILE 139 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ce8 n GLY 140 N -0.00 0.84 3.83 3.28 0.00 0.11 -5.01 105.19 108.24 1ce8 n GLY 140 Ca 0.32 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.96 1ce8 n GLY 140 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ce8 s LEU 141 N 0.00 4.47 0.38 0.99 1.43 0.38 -5.01 118.68 121.32 1ce8 s LEU 141 Ca 0.00 0.98 -0.19 0.00 -1.03 0.00 0.00 54.13 53.89 1ce8 s LEU 141 Cb 0.00 -2.62 -0.10 0.00 0.03 0.00 0.00 46.19 43.50 1ce8 s LEU 141 CO 0.00 0.31 0.86 -0.70 0.23 0.00 0.00 176.35 177.05 1ce8 s GLU 142 N -0.99 4.16 0.17 1.70 2.12 -1.26 -3.86 118.70 120.73 1ce8 s GLU 142 Ca 0.24 0.95 0.02 0.00 0.36 0.00 0.00 54.97 56.54 1ce8 s GLU 142 Cb -0.17 -2.31 -0.05 0.00 0.26 0.00 0.00 34.13 31.86 1ce8 s GLU 142 CO 0.14 0.06 -0.00 0.95 -0.54 0.00 0.00 175.26 175.86 1ce8 s THR 143 N -2.07 0.69 0.66 -1.70 -4.23 -1.26 -0.54 115.64 107.19 1ce8 s THR 143 Ca 0.58 -1.98 -0.13 0.00 -1.18 0.00 0.00 61.69 58.98 1ce8 s THR 143 Cb -0.10 -2.09 -0.00 0.00 1.34 0.00 0.00 72.50 71.65 1ce8 s THR 143 CO 0.15 -0.50 1.07 0.00 -0.54 0.00 0.00 174.62 174.80 1ce8 s ALA 144 N -3.65 2.62 0.26 3.99 0.00 -1.26 -4.95 121.76 118.77 1ce8 s ALA 144 Ca 0.23 0.28 -0.31 0.00 0.00 0.00 0.00 51.96 52.16 1ce8 s ALA 144 Cb 0.06 -3.23 -0.12 0.00 0.00 0.00 0.00 23.12 19.84 1ce8 s ALA 144 CO 0.03 -1.14 1.64 0.50 0.00 0.00 0.00 175.76 176.79 1ce8 s ARG 145 N -4.54 4.12 0.35 0.00 3.52 -1.26 -4.87 118.95 116.27 1ce8 s ARG 145 Ca 0.62 2.59 -0.11 0.00 -0.13 0.00 0.00 55.73 58.70 1ce8 s ARG 145 Cb -0.16 -3.04 0.03 0.00 -1.56 0.00 0.00 34.95 30.22 1ce8 s ARG 145 CO 0.47 -0.68 0.64 -1.54 -0.81 0.00 0.00 175.30 173.38 1ce8 s SER 146 N 0.73 0.32 -0.08 -2.12 1.04 -1.26 -1.55 113.70 110.78 1ce8 s SER 146 Ca 0.67 -1.22 -0.12 0.00 0.48 0.00 0.00 55.95 55.76 1ce8 s SER 146 Cb -0.48 0.75 0.03 0.00 0.10 0.00 0.00 66.02 66.42 1ce8 s SER 146 CO 0.43 -1.48 0.30 -0.83 0.98 0.00 0.00 173.24 172.63 1ce8 s GLY 147 N -3.12 -0.19 -0.04 7.32 0.00 -0.24 -4.99 107.32 106.06 1ce8 s GLY 147 Ca 0.21 0.64 -0.12 0.00 0.00 0.00 0.00 44.72 45.45 1ce8 s GLY 147 CO 0.14 0.50 0.32 -0.42 0.00 0.00 0.00 173.10 173.64 1ce8 s ILE 148 N -0.37 5.19 0.03 0.90 -1.09 -1.26 -0.93 121.20 123.66 1ce8 s ILE 148 Ca -0.05 0.63 0.02 0.00 -2.23 0.00 0.00 60.65 59.02 1ce8 s ILE 148 Cb -0.03 -3.61 -0.02 0.00 -1.58 0.00 0.00 42.46 37.22 1ce8 s ILE 148 CO 0.02 0.59 -0.07 0.00 -1.23 0.00 0.00 174.94 174.25 1ce8 s ALA 149 N -1.06 0.49 0.00 9.38 0.00 0.72 -4.82 121.76 126.47 1ce8 s ALA 149 Ca 0.21 -0.60 0.00 0.00 0.00 0.00 0.00 51.96 51.57 1ce8 s ALA 149 Cb -0.15 0.01 0.00 0.00 0.00 0.00 0.00 23.12 22.98 1ce8 s ALA 149 CO 0.10 0.00 0.00 0.72 0.00 0.00 0.00 175.76 176.59 1ce8 n HIS 150 N 1.89 0.00 -4.12 0.00 8.25 -1.26 -0.83 115.22 119.15 1ce8 n HIS 150 Ca -0.20 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.17 1ce8 n HIS 150 Cb 0.56 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.57 1ce8 n HIS 150 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1ce8 s THR 151 N -0.90 0.15 0.22 1.59 -4.23 -1.26 -4.89 115.64 106.31 1ce8 s THR 151 Ca 0.00 -1.87 -0.08 0.00 -1.18 0.00 0.00 61.69 58.56 1ce8 s THR 151 Cb 0.00 -1.84 0.18 0.00 1.34 0.00 0.00 72.50 72.18 1ce8 s THR 151 CO 0.00 -0.67 1.86 -0.03 -0.54 0.00 0.00 174.62 175.24 1ce8 h MET 152 N 2.97 1.14 -0.72 3.99 4.05 -1.97 0.12 114.93 124.51 1ce8 h MET 152 Ca -0.35 -0.11 -0.00 0.00 -0.28 0.00 0.00 59.70 58.96 1ce8 h MET 152 Cb 1.18 -0.24 -0.04 0.00 -0.80 0.00 0.00 31.60 31.71 1ce8 h MET 152 CO 0.62 0.81 0.44 1.49 0.23 0.00 0.00 176.91 180.50 1ce8 h GLU 153 N 1.15 0.98 -0.22 0.39 4.81 -1.99 0.60 114.58 120.30 1ce8 h GLU 153 Ca 0.30 -0.08 -0.14 0.00 -0.13 0.00 0.00 59.36 59.30 1ce8 h GLU 153 Cb -0.03 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.13 1ce8 h GLU 153 CO -0.05 0.69 -0.45 0.93 -0.73 0.00 0.00 179.01 179.39 1ce8 h GLU 154 N 0.99 0.54 0.07 1.92 5.08 -1.82 -2.82 114.58 118.54 1ce8 h GLU 154 Ca 0.26 -0.30 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1ce8 h GLU 154 Cb -0.05 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1ce8 h GLU 154 CO -0.05 0.89 -0.03 0.00 -1.00 0.00 0.00 179.01 178.81 1ce8 h ALA 155 N 1.07 -0.09 -0.96 3.43 0.00 0.17 -2.63 119.26 120.24 1ce8 h ALA 155 Ca 0.03 -0.09 0.16 0.00 0.00 0.00 0.00 54.91 55.02 1ce8 h ALA 155 Cb 0.96 0.03 -0.08 0.00 0.00 0.00 0.00 17.79 18.70 1ce8 h ALA 155 CO 0.09 -0.48 0.60 -0.07 0.00 0.00 0.00 179.25 179.39 1ce8 h LEU 156 N -0.24 0.71 -0.54 0.00 3.38 0.22 -0.96 115.31 117.89 1ce8 h LEU 156 Ca -0.01 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 1ce8 h LEU 156 Cb 0.20 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1ce8 h LEU 156 CO 0.02 0.32 0.19 0.00 0.09 0.00 0.00 178.44 179.05 1ce8 h ALA 157 N 1.60 0.70 -0.07 1.53 0.00 -1.34 -0.18 119.26 121.50 1ce8 h ALA 157 Ca 0.51 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 1ce8 h ALA 157 Cb 0.81 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1ce8 h ALA 157 CO -0.27 0.34 0.02 0.28 0.00 0.00 0.00 179.25 179.63 1ce8 h VAL 158 N 0.74 1.17 -0.47 0.00 2.07 -0.83 -2.45 116.25 116.48 1ce8 h VAL 158 Ca 0.18 -0.50 0.08 0.00 0.82 0.00 0.00 66.70 67.28 1ce8 h VAL 158 Cb 0.25 1.36 -0.07 0.00 -1.52 0.00 0.00 31.29 31.31 1ce8 h VAL 158 CO -0.01 0.14 0.08 0.00 0.02 0.00 0.00 177.57 177.81 1ce8 h ALA 159 N 0.84 0.51 -1.01 1.67 0.00 -1.22 0.27 119.26 120.32 1ce8 h ALA 159 Ca 0.02 0.10 0.27 0.00 0.00 0.00 0.00 54.91 55.31 1ce8 h ALA 159 Cb 0.20 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.07 1ce8 h ALA 159 CO -0.00 -0.32 0.69 0.00 0.00 0.00 0.00 179.25 179.62 1ce8 h ALA 160 N 1.37 2.59 0.00 0.00 0.00 -0.73 0.75 119.26 123.23 1ce8 h ALA 160 Ca 0.23 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 1ce8 h ALA 160 Cb 0.31 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1ce8 h ALA 160 CO -0.31 -0.92 -0.22 0.22 0.00 0.00 0.00 179.25 178.02 1ce8 h ASP 161 N 0.21 0.00 1.83 0.00 3.58 -0.35 -3.38 116.42 118.31 1ce8 h ASP 161 Ca 0.52 -0.57 0.00 0.00 0.42 0.00 0.00 57.03 57.41 1ce8 h ASP 161 Cb 1.67 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.72 1ce8 h ASP 161 CO -0.14 0.91 0.00 -0.37 -2.88 0.00 0.00 179.24 176.76 1ce8 h VAL 162 N -1.00 0.00 -2.42 2.25 -1.51 -0.03 -3.50 116.25 110.04 1ce8 h VAL 162 Ca -0.05 -0.85 0.26 0.00 -1.23 0.00 0.00 66.70 64.83 1ce8 h VAL 162 Cb 0.72 1.85 -0.12 0.00 -2.13 0.00 0.00 31.29 31.61 1ce8 h VAL 162 CO -0.03 0.00 -0.74 0.61 -1.23 0.00 0.00 177.57 176.18 1ce8 n GLY 163 N 1.13 -2.71 3.89 5.19 0.00 0.25 -4.76 105.19 108.18 1ce8 n GLY 163 Ca 0.04 -1.20 -0.33 0.00 0.00 0.00 0.00 46.02 44.54 1ce8 n GLY 163 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ce8 s PHE 164 N -3.27 3.51 0.60 1.61 0.08 -1.26 -3.78 117.98 115.48 1ce8 s PHE 164 Ca 0.00 0.61 -0.08 0.00 0.12 0.00 0.00 56.93 57.58 1ce8 s PHE 164 Cb 0.00 -2.04 -0.01 0.00 -0.57 0.00 0.00 43.02 40.40 1ce8 s PHE 164 CO 0.00 0.48 0.96 -1.25 -0.10 0.00 0.00 175.22 175.31 1ce8 s PRO 165 N -2.36 3.20 0.10 0.24 0.04 -1.26 -5.03 135.00 129.93 1ce8 s PRO 165 Ca 0.37 0.35 0.01 0.00 0.04 0.00 0.00 61.00 61.77 1ce8 s PRO 165 Cb -0.13 -2.18 -0.04 0.00 0.04 0.00 0.00 34.50 32.19 1ce8 s PRO 165 CO 0.22 -0.65 -0.04 0.00 0.04 0.00 0.00 177.00 176.57 1ce8 s ILE 167 N -3.74 3.96 -0.22 0.00 1.09 0.15 -1.49 121.20 120.96 1ce8 s ILE 167 Ca 0.13 -0.35 -0.06 0.00 -1.10 0.00 0.00 60.65 59.28 1ce8 s ILE 167 Cb 0.06 -2.71 -0.02 0.00 -1.06 0.00 0.00 42.46 38.73 1ce8 s ILE 167 CO -0.05 0.52 0.02 -0.63 -0.10 0.00 0.00 174.94 174.71 1ce8 s ILE 168 N -0.00 4.04 -0.21 2.92 1.01 -0.30 -0.02 121.20 128.63 1ce8 s ILE 168 Ca 0.01 -0.27 -0.02 0.00 0.00 0.00 0.00 60.65 60.37 1ce8 s ILE 168 Cb -0.13 -2.85 0.06 0.00 0.01 0.00 0.00 42.46 39.55 1ce8 s ILE 168 CO 0.03 0.40 0.02 -0.13 0.00 0.00 0.00 174.94 175.25 1ce8 s ARG 169 N 1.25 0.88 0.49 2.79 0.52 0.74 -2.17 118.95 123.45 1ce8 s ARG 169 Ca 0.04 -0.61 -0.21 0.00 -0.52 0.00 0.00 55.73 54.43 1ce8 s ARG 169 Cb -0.15 -2.21 -0.07 0.00 0.52 0.00 0.00 34.95 33.04 1ce8 s ARG 169 CO 0.02 -0.66 1.13 -1.25 0.02 0.00 0.00 175.30 174.56 1ce8 s PRO 170 N 1.73 3.62 0.49 3.54 0.05 -1.26 -1.21 135.00 141.96 1ce8 s PRO 170 Ca -0.01 1.66 -0.19 0.00 0.05 0.00 0.00 61.00 62.51 1ce8 s PRO 170 Cb -0.18 -2.23 -0.09 0.00 0.05 0.00 0.00 34.50 32.06 1ce8 s PRO 170 CO -0.09 -0.64 1.00 -1.12 0.05 0.00 0.00 177.00 176.20 1ce8 s SER 171 N -1.58 6.55 -1.31 6.66 0.01 0.80 -3.70 113.70 121.12 1ce8 s SER 171 Ca 0.67 1.74 -0.01 0.00 1.31 0.00 0.00 55.95 59.66 1ce8 s SER 171 Cb -0.25 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.44 1ce8 s SER 171 CO 0.30 -0.64 0.09 0.49 0.41 0.00 0.00 173.24 173.90 1ce8 n PHE 172 N -1.15 -0.90 -4.17 2.43 3.01 -0.60 -3.91 117.46 112.17 1ce8 n PHE 172 Ca 0.08 0.08 -0.10 0.00 1.01 0.00 0.00 57.45 58.51 1ce8 n PHE 172 Cb 0.53 -3.33 -0.10 0.00 -0.01 0.00 0.00 39.48 36.58 1ce8 n PHE 172 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1ce8 s THR 173 N -2.83 0.51 0.29 4.37 -4.23 -1.24 -4.41 115.64 108.09 1ce8 s THR 173 Ca 0.05 -1.92 -0.01 0.00 -1.18 0.00 0.00 61.69 58.63 1ce8 s THR 173 Cb -0.02 -1.81 -0.02 0.00 1.34 0.00 0.00 72.50 72.00 1ce8 s THR 173 CO 0.06 -0.75 0.34 0.00 -0.54 0.00 0.00 174.62 173.73 1ce8 s MET 174 N -3.90 1.64 -1.76 3.99 0.23 -1.26 -4.87 119.30 113.36 1ce8 s MET 174 Ca 0.15 -1.71 0.00 0.00 -1.03 0.00 0.00 55.69 53.10 1ce8 s MET 174 Cb 0.06 0.37 0.00 0.00 -1.53 0.00 0.00 34.83 33.74 1ce8 s MET 174 CO -0.03 -0.63 0.00 0.41 -2.03 0.00 0.00 175.02 172.74 1ce8 n GLY 175 N -0.47 1.65 2.40 3.16 0.00 -1.26 -2.14 105.19 108.51 1ce8 n GLY 175 Ca 0.02 -0.19 -0.11 0.00 0.00 0.00 0.00 46.02 45.74 1ce8 n GLY 175 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ce8 n GLY 176 N -0.83 1.18 3.66 -0.02 0.00 -1.26 -1.38 105.19 106.54 1ce8 n GLY 176 Ca -0.17 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 1ce8 n GLY 176 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ce8 n SER 177 N -0.09 4.14 0.00 1.61 7.64 -0.91 -1.21 113.62 124.79 1ce8 n SER 177 Ca -0.11 0.91 0.00 0.00 1.01 0.00 0.00 58.87 60.69 1ce8 n SER 177 Cb 0.39 -1.52 0.00 0.00 -1.01 0.00 0.00 64.21 62.07 1ce8 n SER 177 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ce8 n GLY 178 N 4.52 0.43 1.05 0.23 0.00 -1.26 -4.67 105.19 105.50 1ce8 n GLY 178 Ca 0.20 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.14 1ce8 n GLY 178 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ce8 n GLY 179 N -2.22 3.27 0.00 -0.02 0.00 -0.35 -3.32 105.19 102.55 1ce8 n GLY 179 Ca 0.00 -2.22 0.00 0.00 0.00 0.00 0.00 46.02 43.80 1ce8 n GLY 179 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ce8 n GLY 180 N 3.19 0.27 3.58 -0.02 0.00 -0.92 -4.51 105.19 106.77 1ce8 n GLY 180 Ca -0.02 -1.42 -0.35 0.00 0.00 0.00 0.00 46.02 44.23 1ce8 n GLY 180 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ce8 s ILE 181 N -1.82 4.64 -0.22 -0.61 1.01 -1.26 -1.15 121.20 121.79 1ce8 s ILE 181 Ca 0.00 -0.08 -0.07 0.00 0.00 0.00 0.00 60.65 60.50 1ce8 s ILE 181 Cb 0.00 -3.11 -0.03 0.00 0.01 0.00 0.00 42.46 39.33 1ce8 s ILE 181 CO 0.00 0.43 0.06 0.00 0.00 0.00 0.00 174.94 175.43 1ce8 s ALA 182 N 0.67 3.22 -0.71 9.38 0.00 -0.55 -4.93 121.76 128.82 1ce8 s ALA 182 Ca 0.03 -0.99 0.23 0.00 0.00 0.00 0.00 51.96 51.23 1ce8 s ALA 182 Cb -0.13 -1.98 0.01 0.00 0.00 0.00 0.00 23.12 21.01 1ce8 s ALA 182 CO 0.02 -0.22 1.00 0.66 0.00 0.00 0.00 175.76 177.22 1ce8 n TYR 183 N 4.37 0.14 -3.89 0.00 4.01 -1.26 -1.72 117.16 118.82 1ce8 n TYR 183 Ca -0.16 0.04 -0.09 0.00 -0.16 0.00 0.00 57.90 57.53 1ce8 n TYR 183 Cb 0.52 -0.31 -0.01 0.00 -0.31 0.00 0.00 39.34 39.23 1ce8 n TYR 183 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1ce8 s ASN 184 N -3.62 0.07 0.26 7.72 2.20 -1.26 -4.70 114.94 115.61 1ce8 s ASN 184 Ca 0.05 -1.03 0.05 0.00 -0.94 0.00 0.00 52.86 50.98 1ce8 s ASN 184 Cb 0.15 0.75 0.34 0.00 -2.00 0.00 0.00 41.25 40.50 1ce8 s ASN 184 CO 0.81 -1.46 1.63 -0.09 -2.94 0.00 0.00 177.10 175.05 1ce8 h ARG 185 N 2.05 0.28 0.56 3.55 2.43 -1.98 -0.82 114.38 120.46 1ce8 h ARG 185 Ca -0.27 -0.16 -0.02 0.00 -0.81 0.00 0.00 59.98 58.72 1ce8 h ARG 185 Cb 1.25 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 1ce8 h ARG 185 CO 0.35 0.71 -0.30 1.49 -1.51 0.00 0.00 179.97 180.71 1ce8 h GLU 186 N 0.23 -0.77 -0.60 0.20 4.81 -2.00 -1.72 114.58 114.73 1ce8 h GLU 186 Ca 0.01 0.05 0.08 0.00 -0.13 0.00 0.00 59.36 59.38 1ce8 h GLU 186 Cb 0.95 0.17 -0.07 0.00 0.63 0.00 0.00 28.75 30.43 1ce8 h GLU 186 CO 0.08 -0.51 0.25 0.93 -0.73 0.00 0.00 179.01 179.02 1ce8 h GLU 187 N -0.80 0.44 -0.14 1.92 5.08 -1.97 -2.83 114.58 116.28 1ce8 h GLU 187 Ca -0.07 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.31 1ce8 h GLU 187 Cb 0.63 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.72 1ce8 h GLU 187 CO 0.10 0.29 -0.22 0.35 -1.00 0.00 0.00 179.01 178.54 1ce8 h PHE 188 N 0.45 -0.57 -0.54 4.33 3.57 -0.92 -1.16 116.94 122.10 1ce8 h PHE 188 Ca 0.29 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.78 1ce8 h PHE 188 Cb 0.32 0.27 -0.03 0.00 2.79 0.00 0.00 35.95 39.31 1ce8 h PHE 188 CO -0.15 -0.29 0.18 0.93 -2.23 0.00 0.00 178.31 176.75 1ce8 h GLU 189 N -0.27 0.80 -0.10 1.11 5.08 -1.08 0.18 114.58 120.30 1ce8 h GLU 189 Ca 0.10 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1ce8 h GLU 189 Cb 0.42 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 1ce8 h GLU 189 CO -0.30 0.69 -0.00 1.49 -1.00 0.00 0.00 179.01 179.89 1ce8 h GLU 190 N 0.78 0.18 0.14 2.33 4.81 -1.21 -1.98 114.58 119.63 1ce8 h GLU 190 Ca 0.18 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 1ce8 h GLU 190 Cb 0.22 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.58 1ce8 h GLU 190 CO -0.01 0.44 -0.07 0.82 -0.73 0.00 0.00 179.01 179.46 1ce8 h ILE 191 N -0.10 0.93 -0.52 2.32 2.04 -1.09 -1.85 117.51 119.25 1ce8 h ILE 191 Ca 0.03 -0.26 0.06 0.00 1.00 0.00 0.00 64.86 65.69 1ce8 h ILE 191 Cb 0.36 1.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.48 1ce8 h ILE 191 CO 0.01 0.06 0.21 0.00 0.00 0.00 0.00 178.15 178.43 1ce8 h ALA 193 N 1.33 1.31 -0.37 0.00 0.00 -1.29 0.18 119.26 120.41 1ce8 h ALA 193 Ca 0.24 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.98 1ce8 h ALA 193 Cb 0.24 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1ce8 h ALA 193 CO -0.23 0.58 -0.24 -0.09 0.00 0.00 0.00 179.25 179.28 1ce8 h ARG 194 N 1.29 0.81 -0.09 0.00 2.43 -0.37 -3.02 114.38 115.43 1ce8 h ARG 194 Ca 0.39 -0.38 -0.22 0.00 -0.81 0.00 0.00 59.98 58.96 1ce8 h ARG 194 Cb -0.04 -0.01 0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1ce8 h ARG 194 CO -0.11 1.01 -0.83 0.78 -1.51 0.00 0.00 179.97 179.30 1ce8 h GLY 195 N 0.60 0.71 0.95 2.80 0.00 0.17 -2.72 103.07 105.60 1ce8 h GLY 195 Ca 0.07 -1.07 0.02 0.00 0.00 0.00 0.00 47.33 46.35 1ce8 h GLY 195 CO 0.07 0.95 0.65 1.41 0.00 0.00 0.00 176.54 179.62 1ce8 h LEU 196 N 0.42 1.12 -0.23 3.11 3.38 -0.74 0.29 115.31 122.66 1ce8 h LEU 196 Ca -0.06 -0.02 -0.21 0.00 0.09 0.00 0.00 57.88 57.67 1ce8 h LEU 196 Cb 1.46 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1ce8 h LEU 196 CO 0.16 0.79 -0.89 -0.78 0.09 0.00 0.00 178.44 177.81 1ce8 h ASP 197 N 1.31 0.51 0.69 -0.43 3.58 -1.55 -3.31 116.42 117.22 1ce8 h ASP 197 Ca 0.38 -0.39 -0.23 0.00 0.42 0.00 0.00 57.03 57.21 1ce8 h ASP 197 Cb -0.09 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 40.79 1ce8 h ASP 197 CO -0.10 1.18 -1.04 0.25 -2.88 0.00 0.00 179.24 176.65 1ce8 h LEU 198 N 0.24 0.27 -9.50 2.28 5.85 -1.12 -3.45 115.31 109.88 1ce8 h LEU 198 Ca -0.07 -0.26 -0.56 0.00 0.84 0.00 0.00 57.88 57.84 1ce8 h LEU 198 Cb 1.51 -0.09 0.05 0.00 0.37 0.00 0.00 40.66 42.50 1ce8 h LEU 198 CO 0.15 1.14 1.00 -0.24 -0.34 0.00 0.00 178.44 180.15 1ce8 n SER 199 N -3.54 3.66 0.30 1.25 2.88 0.97 -4.84 113.62 114.29 1ce8 n SER 199 Ca -0.05 1.03 0.17 0.00 -1.33 0.00 0.00 58.87 58.69 1ce8 n SER 199 Cb 0.92 -1.49 0.97 0.00 -0.75 0.00 0.00 64.21 63.86 1ce8 n SER 199 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1ce8 h PRO 200 N 7.56 0.00 -0.28 -1.46 0.11 -1.77 -1.67 132.00 134.49 1ce8 h PRO 200 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1ce8 h PRO 200 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1ce8 h PRO 200 CO 0.93 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.97 1ce8 n THR 201 N -3.70 1.55 -3.92 -1.15 -2.24 -1.26 -4.98 114.28 98.57 1ce8 n THR 201 Ca -0.03 -1.40 -0.28 0.00 -2.27 0.00 0.00 64.05 60.07 1ce8 n THR 201 Cb 0.09 0.17 -0.01 0.00 -2.10 0.00 0.00 70.33 68.48 1ce8 n THR 201 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1ce8 n LYS 202 N -0.02 -2.54 -3.93 -0.78 4.81 -0.63 -4.96 118.16 110.11 1ce8 n LYS 202 Ca 0.15 0.38 -0.10 0.00 -0.87 0.00 0.00 58.31 57.87 1ce8 n LYS 202 Cb 0.61 -4.27 -0.12 0.00 0.02 0.00 0.00 35.03 31.28 1ce8 n LYS 202 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 1ce8 s GLU 203 N -6.53 0.21 0.09 1.64 2.12 -1.26 -4.56 118.70 110.41 1ce8 s GLU 203 Ca 0.13 -0.38 0.04 0.00 0.36 0.00 0.00 54.97 55.12 1ce8 s GLU 203 Cb -0.05 0.08 -0.03 0.00 0.26 0.00 0.00 34.13 34.38 1ce8 s GLU 203 CO 0.89 -0.04 -0.11 -0.51 -0.54 0.00 0.00 175.26 174.96 1ce8 s LEU 204 N -0.93 2.38 -0.17 2.70 1.43 -0.01 -0.14 118.68 123.95 1ce8 s LEU 204 Ca -0.10 -0.77 0.01 0.00 -1.03 0.00 0.00 54.13 52.23 1ce8 s LEU 204 Cb -0.06 -0.33 0.02 0.00 0.03 0.00 0.00 46.19 45.85 1ce8 s LEU 204 CO -0.01 -0.23 -0.16 -0.22 0.23 0.00 0.00 176.35 175.96 1ce8 s LEU 205 N -2.32 1.91 -0.24 1.79 2.96 -0.35 -0.20 118.68 122.25 1ce8 s LEU 205 Ca 0.04 -0.59 -0.06 0.00 -0.22 0.00 0.00 54.13 53.29 1ce8 s LEU 205 Cb -0.04 -1.29 -0.02 0.00 0.50 0.00 0.00 46.19 45.34 1ce8 s LEU 205 CO 0.00 -0.05 0.03 -0.63 -1.32 0.00 0.00 176.35 174.38 1ce8 s ILE 206 N 1.41 3.99 0.15 6.68 1.09 -0.10 -0.18 121.20 134.24 1ce8 s ILE 206 Ca 0.04 -0.28 0.10 0.00 -1.10 0.00 0.00 60.65 59.41 1ce8 s ILE 206 Cb -0.13 -2.85 -0.04 0.00 -1.06 0.00 0.00 42.46 38.38 1ce8 s ILE 206 CO -0.11 0.37 -0.24 -1.81 -0.10 0.00 0.00 174.94 173.05 1ce8 s ASP 207 N 1.50 3.18 0.63 3.58 1.11 0.97 -1.08 116.67 126.56 1ce8 s ASP 207 Ca 0.06 -0.80 -0.18 0.00 0.18 0.00 0.00 52.55 51.81 1ce8 s ASP 207 Cb -0.15 -0.21 -0.02 0.00 1.07 0.00 0.00 42.92 43.61 1ce8 s ASP 207 CO 0.01 0.11 1.24 -1.83 1.18 0.00 0.00 175.17 175.89 1ce8 s GLU 208 N -2.36 2.69 0.38 8.23 -1.05 -0.59 0.29 118.70 126.29 1ce8 s GLU 208 Ca 0.16 1.90 -0.25 0.00 -0.15 0.00 0.00 54.97 56.63 1ce8 s GLU 208 Cb -0.09 -1.88 -0.09 0.00 -0.44 0.00 0.00 34.13 31.63 1ce8 s GLU 208 CO 0.07 -1.45 1.09 0.45 0.95 0.00 0.00 175.26 176.37 1ce8 s SER 209 N -1.59 6.77 -0.05 0.83 0.15 -1.21 -4.65 113.70 113.95 1ce8 s SER 209 Ca 0.79 2.15 0.09 0.00 0.70 0.00 0.00 55.95 59.68 1ce8 s SER 209 Cb -0.33 -2.60 0.14 0.00 -1.71 0.00 0.00 66.02 61.53 1ce8 s SER 209 CO 0.37 -0.49 1.07 0.18 1.20 0.00 0.00 173.24 175.58 1ce8 n LEU 210 N 0.16 0.99 -4.63 3.45 4.77 -1.26 -5.09 117.00 115.40 1ce8 n LEU 210 Ca 0.04 -1.91 -0.47 0.00 -0.03 0.00 0.00 56.01 53.64 1ce8 n LEU 210 Cb 0.48 -0.17 -0.04 0.00 -2.33 0.00 0.00 43.42 41.36 1ce8 n LEU 210 CO 0.48 0.47 0.96 -0.38 -1.33 0.00 0.00 177.39 177.59 1ce8 n ILE 211 N -0.53 0.55 0.00 -0.08 5.41 -1.26 -1.35 119.36 122.11 1ce8 n ILE 211 Ca 0.07 -0.14 0.00 0.00 1.00 0.00 0.00 62.75 63.68 1ce8 n ILE 211 Cb 0.70 -1.22 0.00 0.00 -0.71 0.00 0.00 39.64 38.42 1ce8 n ILE 211 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ce8 n GLY 212 N 2.47 1.99 3.78 7.39 0.00 -0.68 -4.94 105.19 115.20 1ce8 n GLY 212 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1ce8 n GLY 212 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ce8 s TRP 213 N -2.37 2.72 0.52 1.61 0.52 -0.45 -4.67 118.94 116.81 1ce8 s TRP 213 Ca 0.00 1.32 -0.20 0.00 0.02 0.00 0.00 56.10 57.25 1ce8 s TRP 213 Cb 0.00 -3.06 -0.07 0.00 -1.15 0.00 0.00 33.47 29.19 1ce8 s TRP 213 CO 0.00 -1.81 1.09 0.15 0.02 0.00 0.00 176.95 176.41 1ce8 s LYS 214 N -5.02 3.53 -0.18 4.98 1.02 0.10 -1.37 119.74 122.80 1ce8 s LYS 214 Ca 0.61 1.51 0.00 0.00 0.02 0.00 0.00 55.97 58.11 1ce8 s LYS 214 Cb -0.16 -2.04 0.01 0.00 -0.52 0.00 0.00 37.83 35.13 1ce8 s LYS 214 CO 0.55 -0.68 -0.17 -2.00 -0.92 0.00 0.00 175.35 172.13 1ce8 s GLU 215 N -3.27 3.06 0.18 1.68 2.12 -1.26 -0.85 118.70 120.37 1ce8 s GLU 215 Ca 0.71 -0.79 0.09 0.00 0.36 0.00 0.00 54.97 55.33 1ce8 s GLU 215 Cb -0.21 -2.64 -0.04 0.00 0.26 0.00 0.00 34.13 31.50 1ce8 s GLU 215 CO 0.24 -0.19 -0.18 0.71 -0.54 0.00 0.00 175.26 175.29 1ce8 s TYR 216 N 1.29 1.89 -0.02 5.30 2.02 -0.36 0.16 117.35 127.63 1ce8 s TYR 216 Ca 0.04 -0.46 -0.05 0.00 -0.37 0.00 0.00 57.07 56.23 1ce8 s TYR 216 Cb -0.13 -0.92 0.00 0.00 -0.40 0.00 0.00 41.96 40.51 1ce8 s TYR 216 CO -0.10 0.38 0.12 -1.21 -1.57 0.00 0.00 175.55 173.16 1ce8 s GLU 217 N -2.97 0.32 -0.03 -0.62 2.02 -0.69 -1.07 118.70 115.65 1ce8 s GLU 217 Ca 0.18 -0.16 0.02 0.00 0.02 0.00 0.00 54.97 55.03 1ce8 s GLU 217 Cb -0.05 0.13 0.01 0.00 0.10 0.00 0.00 34.13 34.32 1ce8 s GLU 217 CO 0.08 -0.06 -0.07 -1.64 0.02 0.00 0.00 175.26 173.58 1ce8 s MET 218 N -0.74 0.95 -0.35 1.61 -1.94 -0.64 0.96 119.30 119.15 1ce8 s MET 218 Ca -0.08 -0.23 -0.17 0.00 -1.71 0.00 0.00 55.69 53.49 1ce8 s MET 218 Cb -0.05 -0.89 -0.00 0.00 2.01 0.00 0.00 34.83 35.89 1ce8 s MET 218 CO 0.01 0.03 0.46 -1.21 -0.01 0.00 0.00 175.02 174.30 1ce8 s GLU 219 N 0.48 3.57 0.16 2.03 0.41 0.31 -2.22 118.70 123.44 1ce8 s GLU 219 Ca -0.07 -0.27 0.08 0.00 -0.41 0.00 0.00 54.97 54.29 1ce8 s GLU 219 Cb -0.11 -3.82 -0.04 0.00 -1.78 0.00 0.00 34.13 28.38 1ce8 s GLU 219 CO 0.01 -0.62 -0.04 0.08 -0.49 0.00 0.00 175.26 174.20 1ce8 s VAL 220 N 2.26 3.53 -0.04 2.63 1.01 -0.62 0.12 120.40 129.29 1ce8 s VAL 220 Ca 0.16 -1.45 0.01 0.00 0.00 0.00 0.00 61.98 60.71 1ce8 s VAL 220 Cb -0.16 -2.74 0.02 0.00 0.00 0.00 0.00 36.38 33.50 1ce8 s VAL 220 CO 0.13 -0.06 -0.04 -0.69 0.00 0.00 0.00 175.10 174.43 1ce8 s VAL 221 N -1.62 0.51 0.12 2.92 1.01 -0.30 -1.48 120.40 121.56 1ce8 s VAL 221 Ca 0.26 -0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.19 1ce8 s VAL 221 Cb -0.10 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 35.71 1ce8 s VAL 221 CO 0.17 0.22 -0.16 -0.60 0.00 0.00 0.00 175.10 174.72 1ce8 s ARG 222 N 0.89 1.08 0.38 2.72 3.52 -0.73 -0.90 118.95 125.91 1ce8 s ARG 222 Ca -0.12 -1.23 0.03 0.00 -0.13 0.00 0.00 55.73 54.28 1ce8 s ARG 222 Cb -0.14 -1.08 -0.01 0.00 -1.56 0.00 0.00 34.95 32.15 1ce8 s ARG 222 CO 0.00 0.22 0.11 -0.40 -0.81 0.00 0.00 175.30 174.43 1ce8 n ASP 223 N 0.65 1.46 0.01 -2.12 5.68 -0.36 -1.76 116.55 120.12 1ce8 n ASP 223 Ca -0.16 -2.94 0.10 0.00 -0.50 0.00 0.00 54.79 51.28 1ce8 n ASP 223 Cb 0.56 0.84 0.42 0.00 -1.14 0.00 0.00 41.12 41.80 1ce8 n ASP 223 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 1ce8 n LYS 224 N -0.86 0.02 -0.50 0.11 2.85 -1.13 -1.76 118.16 116.88 1ce8 n LYS 224 Ca -0.07 0.19 0.06 0.00 -1.05 0.00 0.00 58.31 57.44 1ce8 n LYS 224 Cb 0.55 -1.53 0.27 0.00 -0.65 0.00 0.00 35.03 33.66 1ce8 n LYS 224 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1ce8 n ASN 225 N -1.57 3.79 -1.74 -5.58 3.02 -1.26 -4.84 115.26 107.08 1ce8 n ASN 225 Ca 0.05 -2.42 -0.21 0.00 -0.03 0.00 0.00 54.58 51.97 1ce8 n ASN 225 Cb 0.23 -0.53 -0.08 0.00 -0.61 0.00 0.00 39.78 38.80 1ce8 n ASN 225 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1ce8 n ASP 226 N 0.66 -5.59 -4.67 6.41 2.03 -0.72 -4.93 116.55 109.73 1ce8 n ASP 226 Ca 0.19 0.43 -0.43 0.00 0.52 0.00 0.00 54.79 55.50 1ce8 n ASP 226 Cb 0.75 -4.88 -0.02 0.00 -0.72 0.00 0.00 41.12 36.24 1ce8 n ASP 226 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 1ce8 s ASN 227 N -2.66 7.05 -0.00 1.67 0.01 -1.25 -4.84 114.94 114.91 1ce8 s ASN 227 Ca 0.00 1.66 0.04 0.00 -0.71 0.00 0.00 52.86 53.84 1ce8 s ASN 227 Cb 0.00 -2.55 -0.01 0.00 0.41 0.00 0.00 41.25 39.10 1ce8 s ASN 227 CO 0.00 -0.65 -0.12 0.00 -1.51 0.00 0.00 177.10 174.83 1ce8 s ILE 229 N -0.33 0.14 -0.42 0.00 -4.36 -0.07 -4.98 121.20 111.19 1ce8 s ILE 229 Ca 0.04 -1.19 -0.17 0.00 -0.26 0.00 0.00 60.65 59.07 1ce8 s ILE 229 Cb -0.05 -0.72 0.02 0.00 1.25 0.00 0.00 42.46 42.97 1ce8 s ILE 229 CO -0.00 -0.66 0.43 -0.63 0.24 0.00 0.00 174.94 174.32 1ce8 s ILE 230 N -2.33 5.10 0.14 8.37 -1.09 -1.26 -1.15 121.20 128.98 1ce8 s ILE 230 Ca -0.08 -0.34 -0.08 0.00 -2.23 0.00 0.00 60.65 57.92 1ce8 s ILE 230 Cb -0.04 -4.02 -0.11 0.00 -1.58 0.00 0.00 42.46 36.71 1ce8 s ILE 230 CO -0.04 -0.40 1.39 0.58 -1.23 0.00 0.00 174.94 175.24 1ce8 h VAL 231 N 5.71 1.30 -1.74 2.92 2.07 0.58 -3.38 116.25 123.72 1ce8 h VAL 231 Ca -0.27 -1.93 0.02 0.00 0.82 0.00 0.00 66.70 65.35 1ce8 h VAL 231 Cb 1.11 1.90 -0.22 0.00 -1.52 0.00 0.00 31.29 32.56 1ce8 h VAL 231 CO 0.79 0.61 0.38 0.00 0.02 0.00 0.00 177.57 179.36 1ce8 s SER 233 N -0.64 4.71 -0.03 0.00 1.04 -1.26 -0.53 113.70 116.98 1ce8 s SER 233 Ca -0.03 -0.15 0.02 0.00 0.48 0.00 0.00 55.95 56.27 1ce8 s SER 233 Cb -0.02 -1.10 0.01 0.00 0.10 0.00 0.00 66.02 65.01 1ce8 s SER 233 CO 0.02 0.26 -0.07 -0.63 0.98 0.00 0.00 173.24 173.80 1ce8 s ILE 234 N -1.06 0.67 -0.26 -1.02 1.01 0.27 -3.60 121.20 117.21 1ce8 s ILE 234 Ca 0.19 -0.26 -0.06 0.00 0.00 0.00 0.00 60.65 60.51 1ce8 s ILE 234 Cb -0.11 -0.62 -0.01 0.00 0.01 0.00 0.00 42.46 41.73 1ce8 s ILE 234 CO 0.09 0.23 0.05 -0.70 0.00 0.00 0.00 174.94 174.61 1ce8 s GLU 235 N 0.43 3.37 0.19 2.79 2.12 0.11 -1.71 118.70 126.02 1ce8 s GLU 235 Ca -0.06 -0.66 -0.30 0.00 0.36 0.00 0.00 54.97 54.31 1ce8 s GLU 235 Cb -0.10 -3.27 -0.08 0.00 0.26 0.00 0.00 34.13 30.94 1ce8 s GLU 235 CO 0.01 -0.29 1.27 -0.80 -0.54 0.00 0.00 175.26 174.91 1ce8 s ASN 236 N 1.54 6.97 -0.01 -1.70 0.02 0.12 -1.26 114.94 120.61 1ce8 s ASN 236 Ca 0.05 2.34 -0.24 0.00 -1.02 0.00 0.00 52.86 53.99 1ce8 s ASN 236 Cb -0.16 -2.61 -0.19 0.00 0.02 0.00 0.00 41.25 38.31 1ce8 s ASN 236 CO 0.01 -0.47 1.23 0.15 0.02 0.00 0.00 177.10 178.05 1ce8 h PHE 237 N 5.33 0.18 -3.44 2.20 3.57 -0.40 -3.42 116.94 120.96 1ce8 h PHE 237 Ca -0.45 -0.06 -0.54 0.00 3.53 0.00 0.00 57.97 60.45 1ce8 h PHE 237 Cb 1.21 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.88 1ce8 h PHE 237 CO 0.62 0.67 0.13 -0.51 -2.23 0.00 0.00 178.31 176.99 1ce8 s ASP 238 N -5.96 7.28 1.18 0.41 1.01 -1.21 -4.51 116.67 114.88 1ce8 s ASP 238 Ca -0.15 1.52 -0.17 0.00 0.71 0.00 0.00 52.55 54.46 1ce8 s ASP 238 Cb 0.02 -2.46 0.25 0.00 1.01 0.00 0.00 42.92 41.74 1ce8 s ASP 238 CO 0.71 0.18 0.95 0.00 0.21 0.00 0.00 175.17 177.22 1ce8 n ALA 239 N 1.87 -2.68 -1.76 5.23 0.00 -1.26 -4.68 120.51 117.23 1ce8 n ALA 239 Ca -0.06 -1.38 -0.39 0.00 0.00 0.00 0.00 53.44 51.60 1ce8 n ALA 239 Cb 0.49 -0.09 0.01 0.00 0.00 0.00 0.00 19.45 19.86 1ce8 n ALA 239 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1ce8 s MET 240 N -5.14 3.69 0.00 0.00 -1.94 -0.47 -2.99 119.30 112.45 1ce8 s MET 240 Ca 0.60 2.30 0.00 0.00 -1.71 0.00 0.00 55.69 56.88 1ce8 s MET 240 Cb -0.05 -2.62 0.00 0.00 2.01 0.00 0.00 34.83 34.17 1ce8 s MET 240 CO 0.46 -0.77 0.00 0.41 -0.01 0.00 0.00 175.02 175.10 1ce8 n GLY 241 N 0.62 1.61 3.15 -0.03 0.00 -1.26 -1.69 105.19 107.58 1ce8 n GLY 241 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 1ce8 n GLY 241 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ce8 s ILE 242 N -1.65 2.07 0.34 -0.61 1.01 -1.16 -3.14 121.20 118.06 1ce8 s ILE 242 Ca 0.00 -0.96 -0.26 0.00 0.00 0.00 0.00 60.65 59.43 1ce8 s ILE 242 Cb 0.00 -1.84 -0.13 0.00 0.01 0.00 0.00 42.46 40.50 1ce8 s ILE 242 CO 0.00 0.55 0.79 1.57 0.00 0.00 0.00 174.94 177.84 1ce8 n HIS 243 N 4.31 0.43 -0.30 3.97 -0.00 -0.24 -4.69 115.22 118.70 1ce8 n HIS 243 Ca -0.20 0.69 0.14 0.00 -0.00 0.00 0.00 57.72 58.34 1ce8 n HIS 243 Cb 0.51 -2.12 0.39 0.00 -0.00 0.00 0.00 29.99 28.76 1ce8 n HIS 243 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.34 178.13 1ce8 h THR 244 N 1.39 0.74 0.00 3.57 1.35 -1.92 0.96 112.91 119.00 1ce8 h THR 244 Ca -0.39 -0.23 -0.01 0.00 -0.55 0.00 0.00 66.41 65.24 1ce8 h THR 244 Cb 1.37 0.03 -0.00 0.00 -1.73 0.00 0.00 68.15 67.82 1ce8 h THR 244 CO 0.56 0.12 -0.03 1.23 -0.25 0.00 0.00 175.52 177.15 1ce8 h GLY 245 N 0.66 0.00 -1.59 5.82 0.00 -1.97 -2.19 103.07 103.79 1ce8 h GLY 245 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.84 1ce8 h GLY 245 CO -0.27 0.00 -0.09 1.22 0.00 0.00 0.00 176.54 177.40 1ce8 n ASP 246 N -3.14 2.64 -4.93 0.19 9.92 0.15 -4.71 116.55 116.68 1ce8 n ASP 246 Ca 0.01 -1.82 -0.26 0.00 -0.53 0.00 0.00 54.79 52.19 1ce8 n ASP 246 Cb 0.34 0.10 -0.02 0.00 -0.64 0.00 0.00 41.12 40.90 1ce8 n ASP 246 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 1ce8 s SER 247 N -1.94 6.35 0.10 -2.24 0.01 -0.16 -4.78 113.70 111.04 1ce8 s SER 247 Ca 0.24 0.49 -0.26 0.00 1.31 0.00 0.00 55.95 57.73 1ce8 s SER 247 Cb 0.18 -2.05 -0.06 0.00 0.21 0.00 0.00 66.02 64.30 1ce8 s SER 247 CO 0.33 -0.21 0.81 -0.63 0.41 0.00 0.00 173.24 173.95 1ce8 s ILE 248 N -2.16 4.56 0.04 1.44 1.01 -1.26 -4.32 121.20 120.51 1ce8 s ILE 248 Ca 0.40 1.75 -0.00 0.00 0.00 0.00 0.00 60.65 62.80 1ce8 s ILE 248 Cb -0.10 -4.17 -0.03 0.00 0.01 0.00 0.00 42.46 38.16 1ce8 s ILE 248 CO 0.33 0.41 -0.03 0.42 0.00 0.00 0.00 174.94 176.06 1ce8 s THR 249 N -0.39 0.23 0.08 2.92 -4.23 -0.46 0.38 115.64 114.17 1ce8 s THR 249 Ca 0.39 -1.54 0.03 0.00 -1.18 0.00 0.00 61.69 59.39 1ce8 s THR 249 Cb -0.22 -1.15 -0.03 0.00 1.34 0.00 0.00 72.50 72.44 1ce8 s THR 249 CO 0.26 -0.83 -0.09 0.68 -0.54 0.00 0.00 174.62 174.10 1ce8 s VAL 250 N -3.13 0.80 -0.07 2.29 -7.23 -0.39 -0.62 120.40 112.05 1ce8 s VAL 250 Ca 0.00 -1.55 0.03 0.00 -1.81 0.00 0.00 61.98 58.65 1ce8 s VAL 250 Cb 0.02 -1.24 0.00 0.00 0.56 0.00 0.00 36.38 35.73 1ce8 s VAL 250 CO -0.07 -0.57 -0.17 0.00 -0.31 0.00 0.00 175.10 173.98 1ce8 s ALA 251 N -2.39 1.61 0.57 1.32 0.00 -0.08 0.09 121.76 122.87 1ce8 s ALA 251 Ca 0.03 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.33 1ce8 s ALA 251 Cb -0.03 -0.62 0.00 0.00 0.00 0.00 0.00 23.12 22.47 1ce8 s ALA 251 CO -0.01 0.22 0.00 -0.35 0.00 0.00 0.00 175.76 175.62 1ce8 n PRO 252 N 3.52 0.88 -1.35 0.00 -0.04 -1.26 -1.24 135.00 135.50 1ce8 n PRO 252 Ca -0.20 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 62.91 1ce8 n PRO 252 Cb 0.52 0.00 0.10 0.00 -0.04 0.00 0.00 33.50 34.09 1ce8 n PRO 252 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ce8 s ALA 253 N -3.13 2.04 0.00 0.55 0.00 -1.24 -4.31 121.76 115.67 1ce8 s ALA 253 Ca 0.00 0.96 0.00 0.00 0.00 0.00 0.00 51.96 52.92 1ce8 s ALA 253 Cb 0.00 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.61 1ce8 s ALA 253 CO 0.00 -2.02 0.00 1.04 0.00 0.00 0.00 175.76 174.78 1ce8 n GLN 254 N -2.79 0.76 -0.93 0.00 1.13 -1.26 -4.86 117.38 109.43 1ce8 n GLN 254 Ca 0.14 0.00 -0.08 0.00 -1.94 0.00 0.00 57.00 55.12 1ce8 n GLN 254 Cb 0.50 -0.91 0.23 0.00 0.11 0.00 0.00 30.24 30.17 1ce8 n GLN 254 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1ce8 n THR 255 N -2.18 2.79 -4.38 5.09 -2.24 -1.26 -4.95 114.28 107.16 1ce8 n THR 255 Ca 0.00 -2.11 -0.35 0.00 -2.27 0.00 0.00 64.05 59.32 1ce8 n THR 255 Cb 0.41 -0.36 -0.10 0.00 -2.10 0.00 0.00 70.33 68.18 1ce8 n THR 255 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1ce8 s LEU 256 N -3.14 3.52 0.65 3.22 1.43 -1.26 -5.11 118.68 117.99 1ce8 s LEU 256 Ca 0.50 0.09 -0.11 0.00 -1.03 0.00 0.00 54.13 53.59 1ce8 s LEU 256 Cb 0.43 -1.81 -0.02 0.00 0.03 0.00 0.00 46.19 44.82 1ce8 s LEU 256 CO 0.08 0.34 1.04 0.42 0.23 0.00 0.00 176.35 178.46 1ce8 s THR 257 N -0.66 4.36 0.38 5.49 -4.23 -1.26 -4.82 115.64 114.90 1ce8 s THR 257 Ca 0.10 0.79 0.09 0.00 -1.18 0.00 0.00 61.69 61.49 1ce8 s THR 257 Cb -0.12 -3.63 0.31 0.00 1.34 0.00 0.00 72.50 70.41 1ce8 s THR 257 CO 0.02 -0.98 1.93 -0.78 -0.54 0.00 0.00 174.62 174.27 1ce8 h ASP 258 N -0.44 0.59 -0.20 3.99 3.58 -1.99 -0.22 116.42 121.74 1ce8 h ASP 258 Ca -0.44 0.02 0.02 0.00 0.42 0.00 0.00 57.03 57.05 1ce8 h ASP 258 Cb 1.20 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 42.12 1ce8 h ASP 258 CO 0.59 0.35 0.06 0.11 -2.88 0.00 0.00 179.24 177.47 1ce8 h LYS 259 N 0.66 0.14 -0.49 0.28 1.57 -2.00 -0.55 116.57 116.18 1ce8 h LYS 259 Ca 0.36 -0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 59.02 1ce8 h LYS 259 Cb 0.50 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 1ce8 h LYS 259 CO -0.13 0.10 -0.12 0.93 -0.57 0.00 0.00 179.45 179.65 1ce8 h GLU 260 N 0.15 0.93 -0.80 3.15 5.08 -1.72 -2.82 114.58 118.54 1ce8 h GLU 260 Ca 0.09 -0.34 -0.03 0.00 -1.00 0.00 0.00 59.36 58.08 1ce8 h GLU 260 Cb 0.06 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 1ce8 h GLU 260 CO -0.10 0.99 0.37 -0.92 -1.00 0.00 0.00 179.01 178.36 1ce8 h TYR 261 N 0.83 1.16 -0.22 4.33 5.03 -0.54 -1.77 116.97 125.78 1ce8 h TYR 261 Ca 0.13 -0.06 -0.12 0.00 2.58 0.00 0.00 58.73 61.26 1ce8 h TYR 261 Cb 0.66 -0.36 -0.01 0.00 1.55 0.00 0.00 36.73 38.57 1ce8 h TYR 261 CO 0.04 0.85 -0.36 1.96 -1.32 0.00 0.00 178.16 179.33 1ce8 h GLN 262 N 1.13 0.49 -0.72 1.82 1.08 -0.99 1.17 115.11 119.09 1ce8 h GLN 262 Ca 0.27 -0.23 -0.07 0.00 -1.45 0.00 0.00 58.65 57.18 1ce8 h GLN 262 Cb 0.14 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.53 1ce8 h GLN 262 CO -0.03 0.78 0.19 0.82 -0.95 0.00 0.00 178.83 179.64 1ce8 h ILE 263 N 0.41 1.26 -0.30 2.54 2.04 -1.31 0.63 117.51 122.79 1ce8 h ILE 263 Ca 0.04 -0.95 -0.08 0.00 1.00 0.00 0.00 64.86 64.87 1ce8 h ILE 263 Cb 0.82 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 1ce8 h ILE 263 CO 0.07 0.37 -0.13 -0.03 0.00 0.00 0.00 178.15 178.42 1ce8 h MET 264 N 1.08 0.62 -0.81 2.37 4.05 -0.63 0.23 114.93 121.84 1ce8 h MET 264 Ca 0.23 -0.27 -0.01 0.00 -0.28 0.00 0.00 59.70 59.37 1ce8 h MET 264 Cb 0.35 -0.02 -0.04 0.00 -0.80 0.00 0.00 31.60 31.09 1ce8 h MET 264 CO -0.00 0.84 0.45 -0.09 0.23 0.00 0.00 176.91 178.34 1ce8 h ARG 265 N 0.37 1.12 -0.08 0.39 2.43 0.19 -0.98 114.38 117.82 1ce8 h ARG 265 Ca 0.07 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 1ce8 h ARG 265 Cb 0.65 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1ce8 h ARG 265 CO 0.04 0.81 -0.00 -0.91 -1.51 0.00 0.00 179.97 178.40 1ce8 h ASN 266 N 1.13 0.15 -0.77 -3.80 -0.26 0.73 -2.54 115.58 110.22 1ce8 h ASN 266 Ca 0.29 -0.32 0.05 0.00 -0.56 0.00 0.00 56.30 55.76 1ce8 h ASN 266 Cb 0.01 -0.04 -0.05 0.00 -1.06 0.00 0.00 38.32 37.18 1ce8 h ASN 266 CO -0.05 0.43 0.50 0.00 -1.06 0.00 0.00 177.43 177.26 1ce8 h ALA 267 N 0.72 1.61 -0.17 -0.83 0.00 -0.25 0.12 119.26 120.47 1ce8 h ALA 267 Ca 0.02 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.93 1ce8 h ALA 267 Cb 0.36 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1ce8 h ALA 267 CO 0.01 0.29 0.02 0.77 0.00 0.00 0.00 179.25 180.33 1ce8 h SER 268 N 0.87 -0.01 -0.67 0.00 0.02 -0.98 0.39 113.55 113.17 1ce8 h SER 268 Ca 0.32 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.28 1ce8 h SER 268 Cb 0.17 0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.72 1ce8 h SER 268 CO -0.10 0.02 0.34 0.24 -1.14 0.00 0.00 176.83 176.19 1ce8 h MET 269 N 0.09 0.95 -0.78 3.45 2.86 -0.87 -2.12 114.93 118.50 1ce8 h MET 269 Ca 0.07 -0.13 -0.03 0.00 -2.06 0.00 0.00 59.70 57.55 1ce8 h MET 269 Cb 0.07 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.52 1ce8 h MET 269 CO -0.11 0.74 0.36 0.00 1.06 0.00 0.00 176.91 178.96 1ce8 h ALA 270 N 1.16 1.01 -0.08 6.32 0.00 -0.23 -2.04 119.26 125.40 1ce8 h ALA 270 Ca 0.23 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 55.02 1ce8 h ALA 270 Cb 0.09 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.52 1ce8 h ALA 270 CO -0.03 0.59 -0.24 0.28 0.00 0.00 0.00 179.25 179.84 1ce8 h VAL 271 N 1.11 0.43 -0.45 0.00 2.07 0.42 -0.61 116.25 119.22 1ce8 h VAL 271 Ca 0.27 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.80 1ce8 h VAL 271 Cb 0.14 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 1ce8 h VAL 271 CO -0.03 0.00 0.30 -0.07 0.02 0.00 0.00 177.57 177.79 1ce8 h LEU 272 N -0.33 0.49 -0.17 2.57 4.07 -1.24 0.21 115.31 120.90 1ce8 h LEU 272 Ca 0.09 -0.01 -0.08 0.00 0.08 0.00 0.00 57.88 57.95 1ce8 h LEU 272 Cb 0.45 -0.12 -0.00 0.00 1.08 0.00 0.00 40.66 42.07 1ce8 h LEU 272 CO -0.27 0.35 -0.22 0.03 -1.08 0.00 0.00 178.44 177.25 1ce8 h ARG 273 N 0.57 0.45 -0.36 1.13 3.08 -0.54 -1.15 114.38 117.55 1ce8 h ARG 273 Ca 0.17 -0.26 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 1ce8 h ARG 273 Cb -0.02 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 1ce8 h ARG 273 CO -0.04 0.84 0.13 1.49 -1.07 0.00 0.00 179.97 181.32 1ce8 h GLU 274 N 0.09 0.55 -0.57 0.04 4.57 -0.81 -2.38 114.58 116.08 1ce8 h GLU 274 Ca 0.02 -0.11 0.04 0.00 -1.18 0.00 0.00 59.36 58.14 1ce8 h GLU 274 Cb 0.78 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 29.25 1ce8 h GLU 274 CO 0.05 0.55 0.38 0.82 -1.18 0.00 0.00 179.01 179.63 1ce8 h ILE 275 N 0.44 1.04 0.00 2.32 5.03 -0.97 -3.47 117.51 121.90 1ce8 h ILE 275 Ca 0.12 -0.21 0.00 0.00 -0.12 0.00 0.00 64.86 64.65 1ce8 h ILE 275 Cb 0.21 0.37 0.00 0.00 -3.03 0.00 0.00 36.82 34.37 1ce8 h ILE 275 CO -0.01 0.11 0.00 0.61 -0.68 0.00 0.00 178.15 178.18 1ce8 n GLY 276 N -1.47 1.49 3.43 5.37 0.00 -0.48 -4.26 105.19 109.27 1ce8 n GLY 276 Ca 0.07 -0.16 -0.44 0.00 0.00 0.00 0.00 46.02 45.49 1ce8 n GLY 276 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ce8 s VAL 277 N -2.00 4.89 -0.13 1.61 1.01 -0.91 -4.67 120.40 120.20 1ce8 s VAL 277 Ca 0.00 -1.81 0.17 0.00 0.00 0.00 0.00 61.98 60.34 1ce8 s VAL 277 Cb 0.00 -4.75 -0.09 0.00 0.00 0.00 0.00 36.38 31.54 1ce8 s VAL 277 CO 0.00 -1.45 0.96 -0.33 0.00 0.00 0.00 175.10 174.28 1ce8 h GLU 278 N 8.53 0.00 -1.42 2.72 5.08 -1.85 -3.41 114.58 124.23 1ce8 h GLU 278 Ca 0.16 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 58.03 1ce8 h GLU 278 Cb 1.01 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 29.85 1ce8 h GLU 278 CO 1.07 0.32 -0.92 0.25 -1.00 0.00 0.00 179.01 178.73 1ce8 n THR 279 N -2.95 1.76 -4.00 1.13 -2.24 -1.26 -2.84 114.28 103.88 1ce8 n THR 279 Ca -0.07 -4.27 0.01 0.00 -2.27 0.00 0.00 64.05 57.45 1ce8 n THR 279 Cb 0.81 -0.50 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 1ce8 n THR 279 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ce8 n GLY 280 N -0.26 0.35 3.93 3.38 0.00 -0.72 -3.59 105.19 108.27 1ce8 n GLY 280 Ca 0.26 -0.83 -0.25 0.00 0.00 0.00 0.00 46.02 45.20 1ce8 n GLY 280 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ce8 s GLY 281 N -3.15 1.39 0.03 -0.02 0.00 -1.26 -1.77 107.32 102.55 1ce8 s GLY 281 Ca 0.05 -0.83 -0.27 0.00 0.00 0.00 0.00 44.72 43.67 1ce8 s GLY 281 CO -0.00 -0.74 0.63 -0.56 0.00 0.00 0.00 173.10 172.42 1ce8 s SER 282 N -4.07 -0.59 -0.15 1.64 0.01 -0.55 -3.75 113.70 106.24 1ce8 s SER 282 Ca 0.42 0.40 -0.04 0.00 1.31 0.00 0.00 55.95 58.04 1ce8 s SER 282 Cb -0.10 0.55 -0.03 0.00 0.21 0.00 0.00 66.02 66.66 1ce8 s SER 282 CO 0.38 -0.74 -0.04 0.21 0.41 0.00 0.00 173.24 173.46 1ce8 s ASN 283 N -1.82 4.77 -0.05 2.44 3.84 -0.91 -1.58 114.94 121.62 1ce8 s ASN 283 Ca -0.06 -0.14 0.06 0.00 0.21 0.00 0.00 52.86 52.93 1ce8 s ASN 283 Cb -0.00 -1.78 -0.01 0.00 -0.55 0.00 0.00 41.25 38.91 1ce8 s ASN 283 CO 0.01 0.17 -0.25 -0.69 -2.79 0.00 0.00 177.10 173.55 1ce8 s VAL 284 N 0.36 2.01 0.01 -5.21 1.01 -0.94 -0.00 120.40 117.63 1ce8 s VAL 284 Ca -0.04 -1.05 0.08 0.00 0.00 0.00 0.00 61.98 60.97 1ce8 s VAL 284 Cb -0.14 -1.70 -0.02 0.00 0.00 0.00 0.00 36.38 34.52 1ce8 s VAL 284 CO 0.03 0.56 -0.26 -1.10 0.00 0.00 0.00 175.10 174.33 1ce8 s GLN 285 N -0.21 1.91 0.14 2.72 -0.21 -0.33 -1.62 119.66 122.05 1ce8 s GLN 285 Ca -0.02 -1.00 -0.03 0.00 0.02 0.00 0.00 55.36 54.33 1ce8 s GLN 285 Cb -0.13 -1.96 -0.03 0.00 1.00 0.00 0.00 33.01 31.88 1ce8 s GLN 285 CO 0.03 0.52 0.11 -0.06 -2.12 0.00 0.00 175.29 173.78 1ce8 s PHE 286 N -0.70 0.75 -0.02 0.91 0.08 -0.23 0.56 117.98 119.32 1ce8 s PHE 286 Ca 0.11 -1.12 0.05 0.00 0.12 0.00 0.00 56.93 56.09 1ce8 s PHE 286 Cb -0.10 -0.37 -0.01 0.00 -0.57 0.00 0.00 43.02 41.97 1ce8 s PHE 286 CO 0.01 -0.57 -0.18 0.00 -0.10 0.00 0.00 175.22 174.37 1ce8 s ALA 287 N -4.03 1.54 -0.07 5.36 0.00 0.33 -1.22 121.76 123.67 1ce8 s ALA 287 Ca 0.22 -0.77 0.04 0.00 0.00 0.00 0.00 51.96 51.45 1ce8 s ALA 287 Cb 0.06 -0.43 0.00 0.00 0.00 0.00 0.00 23.12 22.76 1ce8 s ALA 287 CO 0.01 0.35 -0.19 0.08 0.00 0.00 0.00 175.76 176.01 1ce8 s VAL 288 N -0.30 1.63 -0.42 0.00 1.01 -0.03 -1.33 120.40 120.96 1ce8 s VAL 288 Ca 0.04 -0.79 -0.24 0.00 0.00 0.00 0.00 61.98 60.98 1ce8 s VAL 288 Cb -0.08 -1.42 0.02 0.00 0.00 0.00 0.00 36.38 34.90 1ce8 s VAL 288 CO 0.00 0.46 0.86 0.21 0.00 0.00 0.00 175.10 176.63 1ce8 s ASN 289 N 0.27 6.52 0.63 3.32 3.84 -0.10 0.02 114.94 129.44 1ce8 s ASN 289 Ca -0.11 0.19 0.36 0.00 0.21 0.00 0.00 52.86 53.50 1ce8 s ASN 289 Cb -0.15 -2.42 2.03 0.00 -0.55 0.00 0.00 41.25 40.15 1ce8 s ASN 289 CO 0.05 -0.92 2.25 1.55 -2.79 0.00 0.00 177.10 177.25 1ce8 h PRO 290 N 8.82 0.00 -0.00 0.43 0.13 -1.92 0.77 132.00 140.23 1ce8 h PRO 290 Ca -0.24 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.70 1ce8 h PRO 290 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1ce8 h PRO 290 CO 0.98 0.00 -0.83 0.87 -0.23 0.00 0.00 178.00 178.78 1ce8 h LYS 291 N 0.00 0.16 0.00 0.86 1.57 -1.98 -3.38 116.57 113.79 1ce8 h LYS 291 Ca 0.01 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1ce8 h LYS 291 Cb 0.13 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1ce8 h LYS 291 CO -0.00 0.90 0.00 0.27 -0.57 0.00 0.00 179.45 180.05 1ce8 n ASN 292 N -3.66 0.28 0.00 0.86 0.23 -0.77 -4.99 115.26 107.20 1ce8 n ASN 292 Ca -0.03 -1.14 0.00 0.00 -0.53 0.00 0.00 54.58 52.89 1ce8 n ASN 292 Cb 0.78 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.48 1ce8 n ASN 292 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1ce8 n GLY 293 N -0.07 0.33 3.61 4.83 0.00 0.26 -4.94 105.19 109.22 1ce8 n GLY 293 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.51 1ce8 n GLY 293 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ce8 n ARG 294 N -1.34 1.30 -4.00 1.61 0.63 -1.21 -4.60 116.66 109.05 1ce8 n ARG 294 Ca 0.00 0.47 -0.35 0.00 -0.92 0.00 0.00 57.85 57.05 1ce8 n ARG 294 Cb 0.16 -2.14 -0.13 0.00 0.45 0.00 0.00 32.46 30.80 1ce8 n ARG 294 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 1ce8 s LEU 295 N 0.76 3.19 -0.09 6.15 2.96 -1.26 -0.92 118.68 129.46 1ce8 s LEU 295 Ca 0.85 -0.25 0.02 0.00 -0.22 0.00 0.00 54.13 54.53 1ce8 s LEU 295 Cb -0.92 -1.82 0.01 0.00 0.50 0.00 0.00 46.19 43.97 1ce8 s LEU 295 CO 0.47 0.03 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.74 1ce8 s ILE 296 N 1.19 1.44 -0.16 6.68 1.01 -0.44 -4.34 121.20 126.59 1ce8 s ILE 296 Ca 0.03 -0.63 -0.25 0.00 0.00 0.00 0.00 60.65 59.79 1ce8 s ILE 296 Cb -0.15 -1.30 -0.02 0.00 0.01 0.00 0.00 42.46 41.01 1ce8 s ILE 296 CO 0.01 0.43 0.82 -0.69 0.00 0.00 0.00 174.94 175.50 1ce8 s VAL 297 N 0.75 4.90 -0.20 2.92 1.01 0.30 -0.52 120.40 129.57 1ce8 s VAL 297 Ca -0.12 1.62 -0.13 0.00 0.00 0.00 0.00 61.98 63.35 1ce8 s VAL 297 Cb -0.16 -4.13 -0.20 0.00 0.00 0.00 0.00 36.38 31.89 1ce8 s VAL 297 CO 0.02 0.05 0.13 -0.38 0.00 0.00 0.00 175.10 174.92 1ce8 n ILE 298 N 4.63 1.61 -3.58 2.22 2.08 0.19 -4.59 119.36 121.92 1ce8 n ILE 298 Ca 0.04 -0.35 0.03 0.00 0.56 0.00 0.00 62.75 63.03 1ce8 n ILE 298 Cb 0.49 -1.85 -0.00 0.00 -0.75 0.00 0.00 39.64 37.53 1ce8 n ILE 298 CO 0.00 0.00 0.00 -1.83 0.56 0.00 0.00 176.55 175.28 1ce8 s GLU 299 N -2.47 0.09 -0.01 0.38 -1.05 -1.16 -4.98 118.70 109.51 1ce8 s GLU 299 Ca -0.29 -0.05 -0.01 0.00 -0.15 0.00 0.00 54.97 54.47 1ce8 s GLU 299 Cb 0.08 0.03 0.00 0.00 -0.44 0.00 0.00 34.13 33.80 1ce8 s GLU 299 CO 0.64 -0.04 0.02 0.00 0.95 0.00 0.00 175.26 176.82 1ce8 s MET 300 N -2.10 0.02 -0.31 -4.83 0.23 -1.26 -1.19 119.30 109.86 1ce8 s MET 300 Ca 0.15 0.03 -0.02 0.00 -1.03 0.00 0.00 55.69 54.83 1ce8 s MET 300 Cb 0.07 0.01 0.06 0.00 -1.53 0.00 0.00 34.83 33.44 1ce8 s MET 300 CO -0.06 -0.00 0.02 -0.80 -2.03 0.00 0.00 175.02 172.15 1ce8 s ASN 301 N 0.02 4.92 0.00 -1.18 0.01 0.99 -4.76 114.94 114.95 1ce8 s ASN 301 Ca -0.00 -1.40 0.00 0.00 -0.71 0.00 0.00 52.86 50.75 1ce8 s ASN 301 Cb -0.00 -1.72 0.00 0.00 0.41 0.00 0.00 41.25 39.94 1ce8 s ASN 301 CO -0.00 -0.30 0.66 -0.81 -1.51 0.00 0.00 177.10 175.15 1ce8 n PRO 302 N 4.60 0.34 -0.90 -0.60 -0.04 -1.26 -2.14 135.00 135.00 1ce8 n PRO 302 Ca -0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 1ce8 n PRO 302 Cb 0.43 -1.33 0.00 0.00 -0.04 0.00 0.00 33.50 32.56 1ce8 n PRO 302 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1ce8 n ARG 303 N 1.81 0.00 -2.32 0.54 1.85 -1.25 -4.84 116.66 112.46 1ce8 n ARG 303 Ca 0.00 0.00 -0.29 0.00 -1.00 0.00 0.00 57.85 56.56 1ce8 n ARG 303 Cb 0.17 0.00 0.01 0.00 -1.05 0.00 0.00 32.46 31.59 1ce8 n ARG 303 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 1ce8 s VAL 304 N -2.81 4.62 0.00 8.89 -7.23 -0.91 -4.17 120.40 118.79 1ce8 s VAL 304 Ca 0.00 0.41 0.00 0.00 -1.81 0.00 0.00 61.98 60.58 1ce8 s VAL 304 Cb 0.00 -3.80 0.00 0.00 0.56 0.00 0.00 36.38 33.14 1ce8 s VAL 304 CO 0.00 -0.89 0.00 -1.54 -0.31 0.00 0.00 175.10 172.36 1ce8 n SER 305 N -2.50 0.00 0.14 4.85 3.41 -1.26 -4.73 113.62 113.53 1ce8 n SER 305 Ca 0.03 -0.45 0.02 0.00 -0.26 0.00 0.00 58.87 58.21 1ce8 n SER 305 Cb 0.55 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.52 1ce8 n SER 305 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 1ce8 h ARG 306 N 0.00 0.00 0.23 4.33 0.11 -1.95 -1.81 114.38 115.30 1ce8 h ARG 306 Ca 0.00 0.00 -0.33 0.00 0.10 0.00 0.00 59.98 59.75 1ce8 h ARG 306 Cb 0.00 0.00 0.03 0.00 1.11 0.00 0.00 29.97 31.11 1ce8 h ARG 306 CO 0.00 0.51 -1.45 0.77 0.10 0.00 0.00 179.97 179.90 1ce8 h SER 307 N 0.00 0.77 -0.51 0.08 0.02 -1.98 -0.55 113.55 111.39 1ce8 h SER 307 Ca -0.01 -0.83 -0.01 0.00 -0.84 0.00 0.00 61.79 60.10 1ce8 h SER 307 Cb 1.40 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 63.66 1ce8 h SER 307 CO 0.07 1.65 0.27 0.77 -1.14 0.00 0.00 176.83 178.45 1ce8 h SER 308 N 0.13 0.66 -0.30 3.07 4.64 -1.92 0.35 113.55 120.19 1ce8 h SER 308 Ca -0.24 -0.05 -0.11 0.00 -0.47 0.00 0.00 61.79 60.91 1ce8 h SER 308 Cb 2.14 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 64.06 1ce8 h SER 308 CO 0.26 0.56 -0.26 0.00 -0.87 0.00 0.00 176.83 176.52 1ce8 h ALA 309 N 1.55 0.43 -0.43 5.18 0.00 -1.28 -0.58 119.26 124.14 1ce8 h ALA 309 Ca 0.19 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1ce8 h ALA 309 Cb 0.06 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1ce8 h ALA 309 CO -0.03 0.42 0.23 1.25 0.00 0.00 0.00 179.25 181.12 1ce8 h LEU 310 N 0.45 0.55 -0.47 0.00 5.85 0.14 -2.57 115.31 119.25 1ce8 h LEU 310 Ca 0.05 -0.10 0.09 0.00 0.84 0.00 0.00 57.88 58.76 1ce8 h LEU 310 Cb 0.82 -0.14 -0.08 0.00 0.37 0.00 0.00 40.66 41.63 1ce8 h LEU 310 CO 0.07 0.49 -0.00 0.00 -0.34 0.00 0.00 178.44 178.66 1ce8 h ALA 311 N 1.08 0.44 -1.00 1.25 0.00 -0.23 0.70 119.26 121.50 1ce8 h ALA 311 Ca 0.15 0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.23 1ce8 h ALA 311 Cb 0.08 0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.05 1ce8 h ALA 311 CO -0.02 -0.39 0.66 0.77 0.00 0.00 0.00 179.25 180.27 1ce8 h SER 312 N 0.11 1.10 0.28 0.00 0.02 -0.86 0.39 113.55 114.59 1ce8 h SER 312 Ca 0.23 -0.01 -0.22 0.00 -0.84 0.00 0.00 61.79 60.96 1ce8 h SER 312 Cb 0.35 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.63 1ce8 h SER 312 CO -0.39 0.76 -0.88 0.11 -1.14 0.00 0.00 176.83 175.29 1ce8 h LYS 313 N 1.28 0.44 -0.11 3.45 6.56 -0.91 0.25 116.57 127.52 1ce8 h LYS 313 Ca 0.40 -0.43 -0.01 0.00 -1.06 0.00 0.00 60.65 59.54 1ce8 h LYS 313 Cb -0.01 0.11 -0.00 0.00 -0.57 0.00 0.00 32.23 31.76 1ce8 h LYS 313 CO -0.12 1.08 0.01 0.00 -2.06 0.00 0.00 179.45 178.36 1ce8 h ALA 314 N 0.77 0.15 0.09 3.86 0.00 0.13 -3.35 119.26 120.91 1ce8 h ALA 314 Ca -0.07 -0.17 -0.36 0.00 0.00 0.00 0.00 54.91 54.32 1ce8 h ALA 314 Cb 1.50 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.22 1ce8 h ALA 314 CO 0.15 -0.19 -2.07 0.25 0.00 0.00 0.00 179.25 177.40 1ce8 n THR 315 N -4.83 1.70 0.00 0.00 -2.24 0.13 -4.99 114.28 104.06 1ce8 n THR 315 Ca -0.06 -0.66 0.00 0.00 -2.27 0.00 0.00 64.05 61.06 1ce8 n THR 315 Cb 0.18 -1.57 0.00 0.00 -2.10 0.00 0.00 70.33 66.84 1ce8 n THR 315 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ce8 n GLY 316 N 1.99 0.64 3.55 3.38 0.00 0.87 -3.09 105.19 112.52 1ce8 n GLY 316 Ca -0.33 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.27 1ce8 n GLY 316 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ce8 s PHE 317 N -2.00 3.10 -1.28 1.61 2.19 -1.22 -4.73 117.98 115.64 1ce8 s PHE 317 Ca 0.00 0.18 -0.18 0.00 0.33 0.00 0.00 56.93 57.25 1ce8 s PHE 317 Cb 0.00 -3.29 0.02 0.00 -1.31 0.00 0.00 43.02 38.45 1ce8 s PHE 317 CO 0.00 -0.77 1.89 -0.35 1.83 0.00 0.00 175.22 177.82 1ce8 n PRO 318 N 6.22 2.77 -0.27 10.12 -0.04 -1.26 -4.06 135.00 148.47 1ce8 n PRO 318 Ca -0.01 -2.92 0.08 0.00 -0.04 0.00 0.00 63.50 60.61 1ce8 n PRO 318 Cb 0.48 -3.45 0.20 0.00 -0.04 0.00 0.00 33.50 30.69 1ce8 n PRO 318 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1ce8 h ILE 319 N 5.26 0.32 -0.83 0.52 2.04 -1.93 -1.92 117.51 120.98 1ce8 h ILE 319 Ca 0.44 -0.05 -0.02 0.00 1.00 0.00 0.00 64.86 66.23 1ce8 h ILE 319 Cb 0.82 0.18 -0.04 0.00 -0.74 0.00 0.00 36.82 37.04 1ce8 h ILE 319 CO 1.55 0.02 0.44 0.00 0.00 0.00 0.00 178.15 180.17 1ce8 h ALA 320 N 1.74 1.06 0.64 1.87 0.00 -1.91 0.84 119.26 123.50 1ce8 h ALA 320 Ca 0.46 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 1ce8 h ALA 320 Cb 0.85 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1ce8 h ALA 320 CO -0.67 0.58 -0.35 0.87 0.00 0.00 0.00 179.25 179.68 1ce8 h LYS 321 N 1.15 -0.88 0.00 0.00 1.57 -1.58 0.07 116.57 116.89 1ce8 h LYS 321 Ca 0.29 0.06 0.03 0.00 -1.87 0.00 0.00 60.65 59.16 1ce8 h LYS 321 Cb 0.05 0.20 -0.05 0.00 0.08 0.00 0.00 32.23 32.50 1ce8 h LYS 321 CO -0.04 -0.59 -0.38 0.28 -0.57 0.00 0.00 179.45 178.15 1ce8 h VAL 322 N -0.92 0.21 -0.82 0.50 2.07 -1.45 -1.67 116.25 114.17 1ce8 h VAL 322 Ca -0.08 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.64 1ce8 h VAL 322 Cb 0.73 0.21 -0.12 0.00 -1.52 0.00 0.00 31.29 30.58 1ce8 h VAL 322 CO 0.11 0.00 0.25 0.00 0.02 0.00 0.00 177.57 177.95 1ce8 h ALA 323 N 0.08 1.17 0.48 1.67 0.00 -0.76 0.13 119.26 122.03 1ce8 h ALA 323 Ca 0.05 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1ce8 h ALA 323 Cb 0.62 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1ce8 h ALA 323 CO -0.30 -0.38 -0.50 0.00 0.00 0.00 0.00 179.25 178.08 1ce8 h ALA 324 N 1.69 -1.14 -0.85 0.00 0.00 -0.05 -1.85 119.26 117.05 1ce8 h ALA 324 Ca 0.49 -0.18 0.12 0.00 0.00 0.00 0.00 54.91 55.34 1ce8 h ALA 324 Cb 0.92 0.73 -0.08 0.00 0.00 0.00 0.00 17.79 19.36 1ce8 h ALA 324 CO -0.56 -1.18 0.48 0.87 0.00 0.00 0.00 179.25 178.86 1ce8 h LYS 325 N -0.98 0.73 -0.60 0.00 1.57 -0.61 0.88 116.57 117.56 1ce8 h LYS 325 Ca -0.06 -0.04 0.12 0.00 -1.87 0.00 0.00 60.65 58.80 1ce8 h LYS 325 Cb 0.85 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.96 1ce8 h LYS 325 CO -0.07 0.48 0.41 -0.07 -0.57 0.00 0.00 179.45 179.63 1ce8 h LEU 326 N 0.75 0.26 -1.51 2.94 4.07 -0.37 -0.22 115.31 121.23 1ce8 h LEU 326 Ca 0.43 0.01 -0.05 0.00 0.08 0.00 0.00 57.88 58.35 1ce8 h LEU 326 Cb 0.49 -0.04 -0.01 0.00 1.08 0.00 0.00 40.66 42.18 1ce8 h LEU 326 CO -0.29 0.15 -0.25 0.00 -1.08 0.00 0.00 178.44 176.96 1ce8 h ALA 327 N 1.70 1.49 -0.48 1.53 0.00 0.00 -2.42 119.26 121.08 1ce8 h ALA 327 Ca 0.29 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ce8 h ALA 327 Cb 0.73 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1ce8 h ALA 327 CO -0.07 0.32 0.00 1.33 0.00 0.00 0.00 179.25 180.83 1ce8 n VAL 328 N -4.10 2.29 0.00 0.00 0.24 -0.13 -4.44 118.33 112.19 1ce8 n VAL 328 Ca -0.02 -1.16 0.00 0.00 -2.04 0.00 0.00 64.34 61.12 1ce8 n VAL 328 Cb 0.32 -0.31 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1ce8 n VAL 328 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ce8 n GLY 329 N 0.53 2.77 3.73 7.63 0.00 -0.91 0.69 105.19 119.62 1ce8 n GLY 329 Ca 0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 1ce8 n GLY 329 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ce8 s TYR 330 N -2.65 2.25 0.15 1.61 2.02 -1.00 -4.08 117.35 115.64 1ce8 s TYR 330 Ca 0.00 1.58 0.10 0.00 -0.37 0.00 0.00 57.07 58.38 1ce8 s TYR 330 Cb 0.00 -3.14 -0.04 0.00 -0.40 0.00 0.00 41.96 38.37 1ce8 s TYR 330 CO 0.00 -2.20 -0.18 0.95 -1.57 0.00 0.00 175.55 172.55 1ce8 s THR 331 N -2.82 2.78 0.28 -0.71 -4.23 -1.23 -4.40 115.64 105.31 1ce8 s THR 331 Ca 0.63 -1.66 0.01 0.00 -1.18 0.00 0.00 61.69 59.49 1ce8 s THR 331 Cb -0.19 -2.31 0.28 0.00 1.34 0.00 0.00 72.50 71.63 1ce8 s THR 331 CO 0.57 0.01 1.85 -0.07 -0.54 0.00 0.00 174.62 176.44 1ce8 h LEU 332 N 3.46 0.94 -1.07 4.79 3.38 -1.94 0.16 115.31 125.04 1ce8 h LEU 332 Ca -0.49 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.44 1ce8 h LEU 332 Cb 1.18 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 1ce8 h LEU 332 CO 0.47 0.52 -0.20 -2.24 0.09 0.00 0.00 178.44 177.09 1ce8 h ASP 333 N 1.02 0.42 0.24 -0.43 2.03 -1.92 -2.63 116.42 115.15 1ce8 h ASP 333 Ca 0.48 -0.12 -0.10 0.00 -0.73 0.00 0.00 57.03 56.56 1ce8 h ASP 333 Cb 0.42 -0.11 -0.01 0.00 -0.83 0.00 0.00 39.33 38.80 1ce8 h ASP 333 CO -0.24 0.63 -0.39 -0.33 -1.03 0.00 0.00 179.24 177.89 1ce8 h GLU 334 N 0.38 0.20 -6.57 4.15 5.08 -1.09 -3.45 114.58 113.30 1ce8 h GLU 334 Ca 0.06 -0.09 -0.52 0.00 -1.00 0.00 0.00 59.36 57.82 1ce8 h GLU 334 Cb 0.57 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.79 1ce8 h GLU 334 CO 0.04 0.57 0.01 -0.51 -1.00 0.00 0.00 179.01 178.11 1ce8 s LEU 335 N -8.27 4.16 -0.05 1.33 1.43 -0.89 -4.99 118.68 111.41 1ce8 s LEU 335 Ca -0.04 1.16 -0.10 0.00 -1.03 0.00 0.00 54.13 54.12 1ce8 s LEU 335 Cb 0.14 -3.80 -0.05 0.00 0.03 0.00 0.00 46.19 42.51 1ce8 s LEU 335 CO 0.76 -0.10 0.26 -0.04 0.23 0.00 0.00 176.35 177.47 1ce8 s MET 336 N -2.68 3.64 -0.28 1.70 -1.94 -1.26 -0.01 119.30 118.47 1ce8 s MET 336 Ca 0.49 0.08 -0.29 0.00 -1.71 0.00 0.00 55.69 54.26 1ce8 s MET 336 Cb -0.12 -3.18 -0.01 0.00 2.01 0.00 0.00 34.83 33.53 1ce8 s MET 336 CO 0.19 0.72 1.51 1.21 -0.01 0.00 0.00 175.02 178.64 1ce8 s ASN 337 N -1.19 6.42 0.15 3.03 2.47 0.44 -4.61 114.94 121.65 1ce8 s ASN 337 Ca 0.21 1.35 -0.30 0.00 0.42 0.00 0.00 52.86 54.54 1ce8 s ASN 337 Cb -0.14 -2.53 -0.08 0.00 -1.45 0.00 0.00 41.25 37.05 1ce8 s ASN 337 CO 0.10 -1.27 1.52 0.44 -3.72 0.00 0.00 177.10 174.17 1ce8 h ASP 338 N 10.47 -2.00 -0.23 -4.21 5.19 -1.91 -2.06 116.42 121.67 1ce8 h ASP 338 Ca -0.30 0.30 0.00 0.00 -0.62 0.00 0.00 57.03 56.40 1ce8 h ASP 338 Cb 1.13 0.87 0.00 0.00 0.18 0.00 0.00 39.33 41.51 1ce8 h ASP 338 CO 1.03 -0.26 0.00 2.30 -3.12 0.00 0.00 179.24 179.18 1ce8 n ILE 339 N -5.17 0.48 -0.88 0.35 -5.35 -1.26 -3.36 119.36 104.16 1ce8 n ILE 339 Ca 0.01 -0.36 0.08 0.00 -0.27 0.00 0.00 62.75 62.20 1ce8 n ILE 339 Cb 0.27 0.01 0.28 0.00 -1.74 0.00 0.00 39.64 38.45 1ce8 n ILE 339 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1ce8 n THR 340 N 0.21 2.22 -2.11 7.28 -2.24 -1.02 -4.20 114.28 114.41 1ce8 n THR 340 Ca 0.08 -1.68 -0.10 0.00 -2.27 0.00 0.00 64.05 60.08 1ce8 n THR 340 Cb 0.30 -0.16 -0.01 0.00 -2.10 0.00 0.00 70.33 68.36 1ce8 n THR 340 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ce8 n GLY 341 N -0.14 0.06 3.26 3.38 0.00 -1.21 -3.10 105.19 107.44 1ce8 n GLY 341 Ca 0.22 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1ce8 n GLY 341 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ce8 n GLY 342 N -1.08 2.19 0.35 -0.02 0.00 -0.80 -4.90 105.19 100.93 1ce8 n GLY 342 Ca -0.11 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.08 1ce8 n GLY 342 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1ce8 h ARG 343 N 1.90 0.00 -5.73 1.61 -0.00 -1.76 -3.40 114.38 106.99 1ce8 h ARG 343 Ca 0.00 0.00 -0.49 0.00 -0.50 0.00 0.00 59.98 58.99 1ce8 h ARG 343 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 29.97 29.82 1ce8 h ARG 343 CO 0.00 0.00 -0.75 0.95 0.00 0.00 0.00 179.97 180.17 1ce8 s THR 344 N -4.98 1.83 1.19 2.04 -4.23 -1.26 -5.01 115.64 105.20 1ce8 s THR 344 Ca -0.05 -2.13 -0.20 0.00 -1.18 0.00 0.00 61.69 58.13 1ce8 s THR 344 Cb 0.19 -2.00 0.29 0.00 1.34 0.00 0.00 72.50 72.31 1ce8 s THR 344 CO 0.70 -0.49 1.16 -2.16 -0.54 0.00 0.00 174.62 173.29 1ce8 s PRO 345 N -3.36 -1.12 0.01 3.99 0.04 -1.26 0.17 135.00 133.46 1ce8 s PRO 345 Ca 0.21 -0.25 0.23 0.00 0.04 0.00 0.00 61.00 61.23 1ce8 s PRO 345 Cb -0.03 -1.63 0.09 0.00 0.04 0.00 0.00 34.50 32.98 1ce8 s PRO 345 CO 0.07 -3.61 1.11 0.00 0.04 0.00 0.00 177.00 174.61 1ce8 n ALA 346 N -4.65 4.06 -2.60 8.56 0.00 0.98 -3.40 120.51 123.46 1ce8 n ALA 346 Ca 0.15 -0.47 -0.42 0.00 0.00 0.00 0.00 53.44 52.70 1ce8 n ALA 346 Cb 0.60 -0.93 -0.02 0.00 0.00 0.00 0.00 19.45 19.09 1ce8 n ALA 346 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ce8 s SER 347 N -3.17 6.62 -0.21 0.00 1.04 -1.08 -4.85 113.70 112.05 1ce8 s SER 347 Ca 0.08 -1.80 -0.36 0.00 0.48 0.00 0.00 55.95 54.35 1ce8 s SER 347 Cb 0.16 -2.56 0.15 0.00 0.10 0.00 0.00 66.02 63.88 1ce8 s SER 347 CO 0.80 -1.36 1.41 0.72 0.98 0.00 0.00 173.24 175.78 1ce8 s PHE 348 N 4.51 -0.01 -0.28 5.02 -0.71 -1.26 -4.96 117.98 120.29 1ce8 s PHE 348 Ca 0.47 0.00 -0.08 0.00 -1.04 0.00 0.00 56.93 56.28 1ce8 s PHE 348 Cb 0.01 0.50 -0.02 0.00 -1.21 0.00 0.00 43.02 42.30 1ce8 s PHE 348 CO -0.05 -0.02 0.11 -1.21 -1.34 0.00 0.00 175.22 172.72 1ce8 s GLU 349 N -2.03 3.47 0.80 1.99 2.02 -1.26 -4.78 118.70 118.91 1ce8 s GLU 349 Ca 0.13 -0.62 -0.12 0.00 0.02 0.00 0.00 54.97 54.38 1ce8 s GLU 349 Cb 0.03 -3.45 0.08 0.00 0.10 0.00 0.00 34.13 30.88 1ce8 s GLU 349 CO -0.04 -0.32 1.16 -2.14 0.02 0.00 0.00 175.26 173.94 1ce8 s PRO 350 N 1.61 1.77 -0.01 0.39 0.02 -1.26 -5.00 135.00 132.52 1ce8 s PRO 350 Ca 0.05 1.56 0.01 0.00 0.02 0.00 0.00 61.00 62.64 1ce8 s PRO 350 Cb -0.16 -1.81 0.01 0.00 0.02 0.00 0.00 34.50 32.55 1ce8 s PRO 350 CO 0.05 -2.07 -0.03 0.45 -0.33 0.00 0.00 177.00 175.07 1ce8 s SER 351 N -2.54 0.50 0.06 2.53 0.15 0.77 -4.98 113.70 110.19 1ce8 s SER 351 Ca 0.69 -0.07 0.08 0.00 0.70 0.00 0.00 55.95 57.35 1ce8 s SER 351 Cb -0.24 -0.14 -0.03 0.00 -1.71 0.00 0.00 66.02 63.90 1ce8 s SER 351 CO 0.52 -0.00 -0.22 0.27 1.20 0.00 0.00 173.24 175.01 1ce8 s ILE 352 N 0.31 1.77 -0.68 6.45 -4.36 -1.26 -0.71 121.20 122.71 1ce8 s ILE 352 Ca -0.03 -1.33 -0.01 0.00 -0.26 0.00 0.00 60.65 59.02 1ce8 s ILE 352 Cb -0.06 -1.55 0.42 0.00 1.25 0.00 0.00 42.46 42.52 1ce8 s ILE 352 CO -0.01 0.16 1.92 -0.90 0.24 0.00 0.00 174.94 176.36 1ce8 n ASP 353 N 1.63 7.28 -3.24 4.36 5.68 -1.26 -4.91 116.55 126.09 1ce8 n ASP 353 Ca -0.18 -3.80 -0.04 0.00 -0.50 0.00 0.00 54.79 50.27 1ce8 n ASP 353 Cb 0.53 -0.93 0.02 0.00 -1.14 0.00 0.00 41.12 39.61 1ce8 n ASP 353 CO 0.00 0.00 0.00 -0.72 -1.33 0.00 0.00 177.20 175.15 1ce8 s TYR 354 N -3.87 0.10 -0.19 2.11 -0.85 -1.26 -4.87 117.35 108.52 1ce8 s TYR 354 Ca 0.59 -0.57 0.01 0.00 -0.52 0.00 0.00 57.07 56.59 1ce8 s TYR 354 Cb 0.47 0.74 0.03 0.00 0.38 0.00 0.00 41.96 43.58 1ce8 s TYR 354 CO -0.14 -1.07 -0.17 0.08 -1.52 0.00 0.00 175.55 172.73 1ce8 s VAL 355 N -2.10 1.98 -0.20 -3.49 1.01 0.62 -4.59 120.40 113.63 1ce8 s VAL 355 Ca 0.21 -0.99 -0.12 0.00 0.00 0.00 0.00 61.98 61.08 1ce8 s VAL 355 Cb -0.03 -1.85 -0.05 0.00 0.00 0.00 0.00 36.38 34.45 1ce8 s VAL 355 CO 0.07 0.44 0.24 -0.69 0.00 0.00 0.00 175.10 175.16 1ce8 s VAL 356 N 1.30 5.32 -0.05 2.92 1.01 -0.37 -1.45 120.40 129.09 1ce8 s VAL 356 Ca 0.03 0.39 0.06 0.00 0.00 0.00 0.00 61.98 62.47 1ce8 s VAL 356 Cb -0.14 -3.58 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 1ce8 s VAL 356 CO -0.11 0.36 -0.24 -0.89 0.00 0.00 0.00 175.10 174.21 1ce8 s THR 357 N 0.81 2.15 -0.03 3.92 2.01 0.81 -0.90 115.64 124.41 1ce8 s THR 357 Ca 0.12 -1.05 0.05 0.00 0.31 0.00 0.00 61.69 61.13 1ce8 s THR 357 Cb -0.13 -1.77 -0.01 0.00 0.01 0.00 0.00 72.50 70.60 1ce8 s THR 357 CO 0.04 0.57 -0.17 -0.75 -0.69 0.00 0.00 174.62 173.62 1ce8 s LYS 358 N -0.33 1.60 -0.10 4.92 2.20 0.21 0.03 119.74 128.27 1ce8 s LYS 358 Ca 0.02 -0.62 0.02 0.00 -0.36 0.00 0.00 55.97 55.03 1ce8 s LYS 358 Cb -0.12 -1.47 0.01 0.00 -1.51 0.00 0.00 37.83 34.74 1ce8 s LYS 358 CO 0.02 0.31 -0.17 0.42 -0.36 0.00 0.00 175.35 175.58 1ce8 s ILE 359 N -0.20 1.58 0.73 5.43 1.01 -0.76 -1.35 121.20 127.64 1ce8 s ILE 359 Ca 0.02 -0.71 -0.12 0.00 0.00 0.00 0.00 60.65 59.83 1ce8 s ILE 359 Cb -0.09 -1.41 0.03 0.00 0.01 0.00 0.00 42.46 41.00 1ce8 s ILE 359 CO 0.01 0.45 1.10 -2.16 0.00 0.00 0.00 174.94 174.34 1ce8 s PRO 360 N 0.73 2.48 -0.11 2.79 0.04 -1.26 -1.14 135.00 138.53 1ce8 s PRO 360 Ca -0.12 1.25 0.03 0.00 0.04 0.00 0.00 61.00 62.21 1ce8 s PRO 360 Cb -0.16 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.47 1ce8 s PRO 360 CO 0.02 -1.48 -0.23 0.50 0.04 0.00 0.00 177.00 175.85 1ce8 s ARG 361 N -4.60 2.97 0.39 4.56 6.06 0.98 -4.82 118.95 124.49 1ce8 s ARG 361 Ca 0.63 -0.85 0.08 0.00 -2.50 0.00 0.00 55.73 53.09 1ce8 s ARG 361 Cb -0.18 -2.30 -0.04 0.00 0.06 0.00 0.00 34.95 32.48 1ce8 s ARG 361 CO 0.50 0.11 0.19 -0.06 -2.50 0.00 0.00 175.30 173.55 1ce8 s PHE 362 N 0.50 2.65 -0.13 5.12 0.40 -1.26 0.49 117.98 125.75 1ce8 s PHE 362 Ca -0.15 -0.50 0.24 0.00 -0.60 0.00 0.00 56.93 55.92 1ce8 s PHE 362 Cb -0.17 -1.88 0.47 0.00 0.51 0.00 0.00 43.02 41.95 1ce8 s PHE 362 CO 0.05 0.20 1.14 0.09 0.70 0.00 0.00 175.22 177.40 1ce8 n ASN 363 N -1.25 1.30 -0.34 1.36 5.03 -1.26 -4.86 115.26 115.24 1ce8 n ASN 363 Ca -0.01 -2.02 0.22 0.00 0.87 0.00 0.00 54.58 53.65 1ce8 n ASN 363 Cb 0.63 -0.39 0.49 0.00 -1.02 0.00 0.00 39.78 39.49 1ce8 n ASN 363 CO 0.00 0.00 0.00 -0.26 -1.83 0.00 0.00 177.26 175.17 1ce8 h PHE 364 N 1.81 0.74 -0.38 3.10 0.04 -1.91 -0.93 116.94 119.41 1ce8 h PHE 364 Ca -0.18 0.03 0.11 0.00 2.80 0.00 0.00 57.97 60.72 1ce8 h PHE 364 Cb 1.58 -0.21 -0.02 0.00 2.20 0.00 0.00 35.95 39.50 1ce8 h PHE 364 CO 0.34 0.04 0.29 1.05 -0.60 0.00 0.00 178.31 179.43 1ce8 h GLU 365 N 0.42 0.00 0.00 1.51 9.09 -1.98 -0.04 114.58 123.58 1ce8 h GLU 365 Ca 0.63 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.04 1ce8 h GLU 365 Cb 1.51 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.61 1ce8 h GLU 365 CO -0.36 0.00 -0.19 1.63 0.05 0.00 0.00 179.01 180.15 1ce8 n LYS 366 N -4.31 0.21 -3.66 1.06 5.02 -0.35 -4.24 118.16 111.88 1ce8 n LYS 366 Ca 0.06 0.13 -0.27 0.00 -2.02 0.00 0.00 58.31 56.21 1ce8 n LYS 366 Cb 0.47 -1.70 -0.10 0.00 -0.02 0.00 0.00 35.03 33.68 1ce8 n LYS 366 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1ce8 n PHE 367 N -2.04 3.07 -0.06 2.13 3.72 -0.03 -4.97 117.46 119.28 1ce8 n PHE 367 Ca 0.05 -4.18 -0.09 0.00 -0.05 0.00 0.00 57.45 53.19 1ce8 n PHE 367 Cb 0.41 -0.55 -0.02 0.00 -0.94 0.00 0.00 39.48 38.38 1ce8 n PHE 367 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ce8 h ALA 368 N 4.88 -0.22 0.00 4.37 0.00 -1.74 -2.74 119.26 123.81 1ce8 h ALA 368 Ca 0.17 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1ce8 h ALA 368 Cb 0.73 0.61 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1ce8 h ALA 368 CO 0.74 -0.73 0.00 0.41 0.00 0.00 0.00 179.25 179.67 1ce8 n GLY 369 N -1.40 -1.44 3.77 0.00 0.00 -1.26 -4.92 105.19 99.93 1ce8 n GLY 369 Ca -0.01 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.55 1ce8 n GLY 369 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ce8 s ALA 370 N -2.94 2.71 -0.21 4.61 0.00 -1.04 -4.55 121.76 120.34 1ce8 s ALA 370 Ca 0.16 0.88 -0.29 0.00 0.00 0.00 0.00 51.96 52.70 1ce8 s ALA 370 Cb 0.19 -3.38 -0.01 0.00 0.00 0.00 0.00 23.12 19.91 1ce8 s ALA 370 CO 0.51 -0.83 1.32 1.21 0.00 0.00 0.00 175.76 177.97 1ce8 s ASN 371 N -1.68 6.80 -0.16 0.00 3.84 -1.26 -4.89 114.94 117.58 1ce8 s ASN 371 Ca 0.72 1.55 0.17 0.00 0.21 0.00 0.00 52.86 55.51 1ce8 s ASN 371 Cb -0.26 -2.54 0.77 0.00 -0.55 0.00 0.00 41.25 38.68 1ce8 s ASN 371 CO 0.29 -0.91 1.69 -0.90 -2.79 0.00 0.00 177.10 174.48 1ce8 n ASP 372 N 7.10 5.19 -4.81 -4.21 5.68 -1.26 -4.95 116.55 119.29 1ce8 n ASP 372 Ca 0.15 -2.64 -0.38 0.00 -0.50 0.00 0.00 54.79 51.41 1ce8 n ASP 372 Cb 0.45 -0.63 -0.06 0.00 -1.14 0.00 0.00 41.12 39.75 1ce8 n ASP 372 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1ce8 s ARG 373 N -2.21 4.08 0.19 0.11 1.81 -1.26 -4.29 118.95 117.37 1ce8 s ARG 373 Ca 0.53 0.53 -0.30 0.00 -1.72 0.00 0.00 55.73 54.77 1ce8 s ARG 373 Cb 0.37 -3.26 -0.08 0.00 -0.45 0.00 0.00 34.95 31.53 1ce8 s ARG 373 CO 0.22 0.59 1.14 -0.51 -0.68 0.00 0.00 175.30 176.05 1ce8 s LEU 374 N -0.81 4.48 0.00 2.53 1.43 0.50 -4.96 118.68 121.84 1ce8 s LEU 374 Ca 0.26 2.16 0.00 0.00 -1.03 0.00 0.00 54.13 55.52 1ce8 s LEU 374 Cb -0.17 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.44 1ce8 s LEU 374 CO 0.15 -0.27 0.00 1.07 0.23 0.00 0.00 176.35 177.52 1ce8 n THR 375 N 2.30 0.00 0.79 5.49 5.66 -1.26 -4.83 114.28 122.43 1ce8 n THR 375 Ca 0.03 0.00 0.13 0.00 -3.05 0.00 0.00 64.05 61.16 1ce8 n THR 375 Cb 0.45 0.00 0.49 0.00 -1.55 0.00 0.00 70.33 69.72 1ce8 n THR 375 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1ce8 n THR 376 N 0.00 0.33 -3.55 1.09 -2.24 -1.19 -1.08 114.28 107.65 1ce8 n THR 376 Ca 0.00 -0.16 -0.38 0.00 -2.27 0.00 0.00 64.05 61.24 1ce8 n THR 376 Cb 0.00 -0.52 -0.10 0.00 -2.10 0.00 0.00 70.33 67.61 1ce8 n THR 376 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1ce8 s GLN 377 N -3.06 4.02 0.46 -0.78 0.74 -1.26 -4.10 119.66 115.69 1ce8 s GLN 377 Ca 0.12 -0.17 -0.24 0.00 0.05 0.00 0.00 55.36 55.12 1ce8 s GLN 377 Cb 0.15 -3.61 -0.09 0.00 1.10 0.00 0.00 33.01 30.56 1ce8 s GLN 377 CO 0.57 -0.11 1.10 -1.33 -0.55 0.00 0.00 175.29 174.97 1ce8 n MET 378 N 4.83 1.48 0.00 1.67 2.81 -0.48 -4.92 117.12 122.50 1ce8 n MET 378 Ca -0.13 0.53 0.00 0.00 -1.81 0.00 0.00 57.70 56.30 1ce8 n MET 378 Cb 0.52 -2.20 0.00 0.00 -0.71 0.00 0.00 33.22 30.83 1ce8 n MET 378 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1ce8 n LYS 379 N -0.13 0.74 -2.23 0.03 5.02 -1.26 -4.92 118.16 115.41 1ce8 n LYS 379 Ca 0.09 -0.05 -0.33 0.00 -2.02 0.00 0.00 58.31 56.01 1ce8 n LYS 379 Cb 0.41 -0.32 -0.01 0.00 -0.02 0.00 0.00 35.03 35.09 1ce8 n LYS 379 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1ce8 s SER 380 N -0.12 6.11 -0.01 4.39 1.04 -1.26 -4.64 113.70 119.21 1ce8 s SER 380 Ca 0.00 1.77 0.14 0.00 0.48 0.00 0.00 55.95 58.33 1ce8 s SER 380 Cb 0.00 -2.53 -0.19 0.00 0.10 0.00 0.00 66.02 63.40 1ce8 s SER 380 CO 0.00 -0.94 0.39 1.33 0.98 0.00 0.00 173.24 175.00 1ce8 n VAL 381 N -1.73 0.00 -2.51 5.02 0.24 0.18 -4.36 118.33 115.18 1ce8 n VAL 381 Ca 0.08 -0.27 0.00 0.00 -2.04 0.00 0.00 64.34 62.11 1ce8 n VAL 381 Cb 0.53 0.45 0.00 0.00 -1.47 0.00 0.00 33.84 33.35 1ce8 n VAL 381 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ce8 n GLY 382 N 1.58 2.71 3.58 7.63 0.00 -0.98 -4.58 105.19 115.13 1ce8 n GLY 382 Ca -0.01 -0.91 -0.10 0.00 0.00 0.00 0.00 46.02 45.00 1ce8 n GLY 382 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ce8 s GLU 383 N -0.32 0.54 0.14 1.61 -1.05 -1.26 -0.02 118.70 118.35 1ce8 s GLU 383 Ca 0.00 0.13 0.09 0.00 -0.15 0.00 0.00 54.97 55.04 1ce8 s GLU 383 Cb 0.00 0.25 -0.04 0.00 -0.44 0.00 0.00 34.13 33.90 1ce8 s GLU 383 CO 0.00 -0.17 -0.21 0.54 0.95 0.00 0.00 175.26 176.37 1ce8 s VAL 384 N -1.11 1.90 0.13 1.83 0.11 -0.29 -4.27 120.40 118.70 1ce8 s VAL 384 Ca -0.01 -1.78 0.08 0.00 -2.93 0.00 0.00 61.98 57.34 1ce8 s VAL 384 Cb -0.00 -1.79 -0.04 0.00 -1.53 0.00 0.00 36.38 33.02 1ce8 s VAL 384 CO 0.01 -0.15 -0.17 -0.32 -3.33 0.00 0.00 175.10 171.13 1ce8 s MET 385 N -2.38 1.14 0.03 1.54 0.00 0.13 -1.83 119.30 117.94 1ce8 s MET 385 Ca 0.13 -1.28 -0.01 0.00 0.00 0.00 0.00 55.69 54.53 1ce8 s MET 385 Cb -0.08 -1.20 -0.02 0.00 0.00 0.00 0.00 34.83 33.53 1ce8 s MET 385 CO 0.06 0.25 -0.00 0.00 0.00 0.00 0.00 175.02 175.33 1ce8 s ALA 386 N -1.83 0.21 -0.08 4.11 0.00 0.10 -4.82 121.76 119.46 1ce8 s ALA 386 Ca 0.11 -0.79 0.03 0.00 0.00 0.00 0.00 51.96 51.31 1ce8 s ALA 386 Cb -0.07 0.21 0.01 0.00 0.00 0.00 0.00 23.12 23.27 1ce8 s ALA 386 CO 0.05 -0.26 -0.18 0.42 0.00 0.00 0.00 175.76 175.79 1ce8 s ILE 387 N -2.51 1.57 0.09 0.00 1.01 -1.26 -0.13 121.20 119.96 1ce8 s ILE 387 Ca -0.06 -0.73 -0.03 0.00 0.00 0.00 0.00 60.65 59.83 1ce8 s ILE 387 Cb -0.02 -1.39 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 1ce8 s ILE 387 CO -0.05 0.45 0.06 -0.83 0.00 0.00 0.00 174.94 174.58 1ce8 s GLY 388 N 0.54 0.51 0.35 6.18 0.00 -0.53 -4.71 107.32 109.65 1ce8 s GLY 388 Ca -0.16 -1.11 0.26 0.00 0.00 0.00 0.00 44.72 43.70 1ce8 s GLY 388 CO 0.06 -1.18 1.74 3.21 0.00 0.00 0.00 173.10 176.93 1ce8 h ARG 389 N 2.95 0.00 -4.19 2.90 2.47 -1.86 0.18 114.38 116.83 1ce8 h ARG 389 Ca -0.34 0.00 -0.15 0.00 -1.26 0.00 0.00 59.98 58.23 1ce8 h ARG 389 Cb 1.17 0.00 -0.17 0.00 -1.65 0.00 0.00 29.97 29.32 1ce8 h ARG 389 CO 0.61 0.00 -0.69 0.95 0.56 0.00 0.00 179.97 181.40 1ce8 s THR 390 N -3.25 0.22 0.32 2.04 -4.23 -1.26 -4.60 115.64 104.88 1ce8 s THR 390 Ca 0.07 -1.49 0.05 0.00 -1.18 0.00 0.00 61.69 59.14 1ce8 s THR 390 Cb 0.09 -1.08 0.30 0.00 1.34 0.00 0.00 72.50 73.15 1ce8 s THR 390 CO 0.59 -0.81 1.84 -0.61 -0.54 0.00 0.00 174.62 175.10 1ce8 h GLN 391 N 3.68 0.81 0.07 3.99 5.75 -1.89 0.53 115.11 128.06 1ce8 h GLN 391 Ca -0.33 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.11 1ce8 h GLN 391 Cb 1.17 -0.18 0.00 0.00 1.07 0.00 0.00 27.48 29.53 1ce8 h GLN 391 CO 0.57 0.54 -0.04 1.96 -2.65 0.00 0.00 178.83 179.21 1ce8 h GLN 392 N 0.84 -0.10 -0.70 1.69 4.20 -1.94 0.63 115.11 119.73 1ce8 h GLN 392 Ca 0.49 0.01 -0.06 0.00 0.06 0.00 0.00 58.65 59.15 1ce8 h GLN 392 Cb 0.64 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.41 1ce8 h GLN 392 CO -0.25 0.22 0.22 1.49 -0.67 0.00 0.00 178.83 179.84 1ce8 h GLU 393 N -0.42 1.09 0.10 1.46 4.81 -1.36 -1.36 114.58 118.90 1ce8 h GLU 393 Ca -0.01 -0.24 -0.00 0.00 -0.13 0.00 0.00 59.36 58.98 1ce8 h GLU 393 Cb 0.36 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.59 1ce8 h GLU 393 CO 0.02 0.94 -0.05 1.03 -0.73 0.00 0.00 179.01 180.22 1ce8 h SER 394 N 1.03 -0.11 -0.24 1.04 0.87 0.23 -1.72 113.55 114.66 1ce8 h SER 394 Ca 0.23 -0.02 0.02 0.00 -1.23 0.00 0.00 61.79 60.79 1ce8 h SER 394 Cb 0.31 0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.27 1ce8 h SER 394 CO -0.01 -0.05 0.08 0.25 -0.53 0.00 0.00 176.83 176.57 1ce8 h LEU 395 N -0.16 0.09 -0.71 2.23 5.85 0.58 -2.01 115.31 121.18 1ce8 h LEU 395 Ca -0.01 0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.63 1ce8 h LEU 395 Cb 0.12 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 1ce8 h LEU 395 CO 0.02 0.08 -0.15 1.56 -0.34 0.00 0.00 178.44 179.61 1ce8 h GLN 396 N 0.19 0.83 -0.63 1.25 4.20 -1.20 -1.80 115.11 117.95 1ce8 h GLN 396 Ca 0.10 -0.30 0.00 0.00 0.06 0.00 0.00 58.65 58.51 1ce8 h GLN 396 Cb 0.07 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.77 1ce8 h GLN 396 CO -0.11 0.93 0.40 0.87 -0.67 0.00 0.00 178.83 180.25 1ce8 h LYS 397 N 0.74 0.84 -0.38 1.46 1.57 -1.20 -0.64 116.57 118.97 1ce8 h LYS 397 Ca 0.11 -0.07 0.02 0.00 -1.87 0.00 0.00 60.65 58.85 1ce8 h LYS 397 Cb 0.66 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.76 1ce8 h LYS 397 CO 0.05 0.59 0.22 0.00 -0.57 0.00 0.00 179.45 179.73 1ce8 h ALA 398 N 1.21 0.48 -0.91 3.86 0.00 -1.02 -1.69 119.26 121.19 1ce8 h ALA 398 Ca 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1ce8 h ALA 398 Cb -0.06 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 1ce8 h ALA 398 CO -0.05 -0.13 0.58 -0.07 0.00 0.00 0.00 179.25 179.59 1ce8 h LEU 399 N 0.44 1.06 -0.25 0.00 3.38 -0.89 -1.94 115.31 117.12 1ce8 h LEU 399 Ca 0.15 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1ce8 h LEU 399 Cb 0.01 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.50 1ce8 h LEU 399 CO -0.08 0.79 0.00 0.08 0.09 0.00 0.00 178.44 179.32 1ce8 h ARG 400 N 1.24 0.00 -0.10 1.13 0.11 -0.68 -3.08 114.38 113.00 1ce8 h ARG 400 Ca 0.33 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.41 1ce8 h ARG 400 Cb -0.11 0.00 0.00 0.00 1.11 0.00 0.00 29.97 30.97 1ce8 h ARG 400 CO -0.07 0.00 0.00 0.41 0.10 0.00 0.00 179.97 180.41 1ce8 n GLY 401 N 0.93 0.83 0.05 0.08 0.00 -0.67 -4.43 105.19 101.98 1ce8 n GLY 401 Ca 0.04 -0.62 0.08 0.00 0.00 0.00 0.00 46.02 45.52 1ce8 n GLY 401 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ce8 n LEU 402 N 1.01 0.24 -1.87 0.99 7.94 -0.93 -4.49 117.00 119.89 1ce8 n LEU 402 Ca 0.16 0.57 -0.19 0.00 -1.11 0.00 0.00 56.01 55.45 1ce8 n LEU 402 Cb 0.52 -0.56 -0.04 0.00 0.53 0.00 0.00 43.42 43.88 1ce8 n LEU 402 CO 0.15 -0.45 -0.22 -0.62 -1.11 0.00 0.00 177.39 175.14 1ce8 n GLU 403 N -1.78 -1.42 -0.22 1.96 -0.58 -1.26 -4.82 120.64 112.51 1ce8 n GLU 403 Ca 0.02 1.01 0.06 0.00 -0.42 0.00 0.00 57.16 57.83 1ce8 n GLU 403 Cb 0.14 -5.46 0.16 0.00 -0.57 0.00 0.00 31.44 25.72 1ce8 n GLU 403 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1ce8 n VAL 404 N -3.41 1.46 -0.78 2.62 0.24 -1.26 -4.95 118.33 112.25 1ce8 n VAL 404 Ca -0.21 -1.37 0.00 0.00 -2.04 0.00 0.00 64.34 60.72 1ce8 n VAL 404 Cb 0.65 0.21 0.00 0.00 -1.47 0.00 0.00 33.84 33.23 1ce8 n VAL 404 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ce8 n GLY 405 N -0.11 0.67 3.83 7.63 0.00 -1.26 -5.04 105.19 110.92 1ce8 n GLY 405 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 1ce8 n GLY 405 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ce8 s ALA 406 N -2.36 3.41 -0.99 4.61 0.00 -1.26 -4.93 121.76 120.24 1ce8 s ALA 406 Ca 0.00 0.07 0.10 0.00 0.00 0.00 0.00 51.96 52.13 1ce8 s ALA 406 Cb 0.00 -2.75 0.19 0.00 0.00 0.00 0.00 23.12 20.55 1ce8 s ALA 406 CO 0.00 0.35 1.05 0.25 0.00 0.00 0.00 175.76 177.41 1ce8 n THR 407 N 0.32 0.58 0.00 0.00 -2.24 -1.26 -4.35 114.28 107.33 1ce8 n THR 407 Ca -0.00 -0.79 0.00 0.00 -2.27 0.00 0.00 64.05 60.99 1ce8 n THR 407 Cb 0.52 0.80 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 1ce8 n THR 407 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ce8 n GLY 408 N 0.46 0.35 2.31 3.38 0.00 -1.26 -4.37 105.19 106.06 1ce8 n GLY 408 Ca 0.08 -1.00 -0.36 0.00 0.00 0.00 0.00 46.02 44.74 1ce8 n GLY 408 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ce8 n PHE 409 N 0.00 2.21 -1.76 1.61 3.01 -1.26 -4.90 117.46 116.36 1ce8 n PHE 409 Ca 0.00 -2.90 -0.40 0.00 1.01 0.00 0.00 57.45 55.16 1ce8 n PHE 409 Cb 0.00 -2.31 0.02 0.00 -0.01 0.00 0.00 39.48 37.18 1ce8 n PHE 409 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1ce8 n ASP 410 N 3.18 3.39 -4.75 4.37 8.00 -1.26 -4.93 116.55 124.54 1ce8 n ASP 410 Ca 0.73 1.13 -0.41 0.00 0.71 0.00 0.00 54.79 56.95 1ce8 n ASP 410 Cb 0.30 -1.61 -0.03 0.00 -0.02 0.00 0.00 41.12 39.76 1ce8 n ASP 410 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 1ce8 s PRO 411 N -2.42 4.42 -0.21 -0.24 0.02 -1.26 -4.90 135.00 130.42 1ce8 s PRO 411 Ca 0.60 2.07 0.13 0.00 0.02 0.00 0.00 61.00 63.82 1ce8 s PRO 411 Cb -0.45 -3.14 -0.22 0.00 0.02 0.00 0.00 34.50 30.71 1ce8 s PRO 411 CO 0.58 -0.14 -0.02 1.17 -0.33 0.00 0.00 177.00 178.27 1ce8 n LYS 412 N 1.62 0.76 -4.21 5.54 3.00 -1.26 -4.99 118.16 118.62 1ce8 n LYS 412 Ca 0.02 0.04 -0.20 0.00 -0.00 0.00 0.00 58.31 58.17 1ce8 n LYS 412 Cb 0.43 -1.50 -0.12 0.00 0.00 0.00 0.00 35.03 33.84 1ce8 n LYS 412 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 1ce8 s VAL 413 N -2.48 1.31 0.40 3.15 -7.23 -1.26 -5.13 120.40 109.15 1ce8 s VAL 413 Ca -0.17 -1.43 -0.26 0.00 -1.81 0.00 0.00 61.98 58.31 1ce8 s VAL 413 Cb 0.07 -1.27 -0.09 0.00 0.56 0.00 0.00 36.38 35.65 1ce8 s VAL 413 CO 0.73 -0.21 1.28 -0.55 -0.31 0.00 0.00 175.10 176.04 1ce8 s SER 414 N -1.90 6.37 0.08 4.85 0.15 -1.26 -4.97 113.70 117.02 1ce8 s SER 414 Ca 0.02 2.61 -0.19 0.00 0.70 0.00 0.00 55.95 59.09 1ce8 s SER 414 Cb -0.09 -2.64 -0.09 0.00 -1.71 0.00 0.00 66.02 61.49 1ce8 s SER 414 CO 0.03 -0.80 1.51 -0.07 1.20 0.00 0.00 173.24 175.10 1ce8 h LEU 415 N 2.72 0.41 0.00 3.45 3.38 -2.01 -2.39 115.31 120.87 1ce8 h LEU 415 Ca -0.49 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.16 1ce8 h LEU 415 Cb 1.24 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1ce8 h LEU 415 CO 0.63 0.63 0.00 -0.90 0.09 0.00 0.00 178.44 178.89 1ce8 n ASP 416 N -4.64 0.00 -4.62 -0.43 5.68 -1.26 -4.78 116.55 106.50 1ce8 n ASP 416 Ca -0.04 -0.85 -0.43 0.00 -0.50 0.00 0.00 54.79 52.98 1ce8 n ASP 416 Cb 0.25 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.21 1ce8 n ASP 416 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1ce8 s ASP 417 N -1.91 6.54 0.57 -1.12 2.15 -0.90 -4.89 116.67 117.11 1ce8 s ASP 417 Ca 0.32 1.01 0.28 0.00 0.43 0.00 0.00 52.55 54.59 1ce8 s ASP 417 Cb 0.15 -2.54 1.69 0.00 -0.30 0.00 0.00 42.92 41.91 1ce8 s ASP 417 CO 0.25 -1.23 2.21 1.55 -0.17 0.00 0.00 175.17 177.78 1ce8 h PRO 418 N 9.82 0.00 -0.02 4.34 0.13 -1.88 -1.99 132.00 142.40 1ce8 h PRO 418 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1ce8 h PRO 418 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1ce8 h PRO 418 CO 1.06 0.03 -0.21 0.39 -0.23 0.00 0.00 178.00 179.04 1ce8 n GLU 419 N -3.88 1.74 -0.21 0.86 1.02 -1.26 -4.55 120.64 114.35 1ce8 n GLU 419 Ca -0.03 -1.42 -0.03 0.00 -0.02 0.00 0.00 57.16 55.66 1ce8 n GLU 419 Cb 0.12 -1.43 0.03 0.00 -0.02 0.00 0.00 31.44 30.14 1ce8 n GLU 419 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ce8 h ALA 420 N 4.02 0.14 -0.26 0.62 0.00 -1.66 0.34 119.26 122.45 1ce8 h ALA 420 Ca 0.00 0.20 0.08 0.00 0.00 0.00 0.00 54.91 55.19 1ce8 h ALA 420 Cb 0.82 0.68 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 1ce8 h ALA 420 CO 0.00 -0.58 0.27 -0.07 0.00 0.00 0.00 179.25 178.87 1ce8 h LEU 421 N -0.11 0.00 0.16 0.00 3.38 -1.80 -1.50 115.31 115.44 1ce8 h LEU 421 Ca 0.27 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.94 1ce8 h LEU 421 Cb 0.53 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.32 1ce8 h LEU 421 CO -0.69 0.00 -1.24 0.74 0.09 0.00 0.00 178.44 177.34 1ce8 h THR 422 N 0.00 1.31 0.23 0.22 2.02 -0.65 -2.75 112.91 113.30 1ce8 h THR 422 Ca 0.13 -2.52 -0.01 0.00 0.77 0.00 0.00 66.41 64.77 1ce8 h THR 422 Cb 0.67 2.85 0.00 0.00 -1.74 0.00 0.00 68.15 69.93 1ce8 h THR 422 CO -0.00 0.76 -0.11 0.11 0.37 0.00 0.00 175.52 176.64 1ce8 h LYS 423 N 0.15 -0.30 -0.71 6.66 1.57 -1.06 -2.64 116.57 120.24 1ce8 h LYS 423 Ca -0.20 0.02 0.16 0.00 -1.87 0.00 0.00 60.65 58.76 1ce8 h LYS 423 Cb 1.94 0.07 -0.12 0.00 0.08 0.00 0.00 32.23 34.20 1ce8 h LYS 423 CO 0.24 -0.12 0.01 0.82 -0.57 0.00 0.00 179.45 179.83 1ce8 h ILE 424 N -0.42 0.40 -0.71 1.86 2.04 -1.41 0.53 117.51 119.79 1ce8 h ILE 424 Ca -0.03 -0.04 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 1ce8 h ILE 424 Cb 0.32 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 1ce8 h ILE 424 CO 0.05 0.02 0.28 -0.09 0.00 0.00 0.00 178.15 178.42 1ce8 h ARG 425 N 0.11 1.06 -0.20 2.37 2.43 -1.33 0.04 114.38 118.87 1ce8 h ARG 425 Ca 0.38 -0.19 -0.02 0.00 -0.81 0.00 0.00 59.98 59.34 1ce8 h ARG 425 Cb 0.65 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.02 1ce8 h ARG 425 CO -0.61 0.88 0.05 -0.09 -1.51 0.00 0.00 179.97 178.68 1ce8 h ARG 426 N 1.02 0.31 0.00 0.20 1.12 -0.82 0.84 114.38 117.05 1ce8 h ARG 426 Ca 0.24 -0.07 -0.02 0.00 -1.11 0.00 0.00 59.98 59.01 1ce8 h ARG 426 Cb 0.21 -0.04 -0.00 0.00 -0.01 0.00 0.00 29.97 30.13 1ce8 h ARG 426 CO -0.02 0.43 -0.11 0.93 -3.11 0.00 0.00 179.97 178.09 1ce8 h GLU 427 N 0.13 0.00 0.10 0.20 4.39 -0.72 -0.18 114.58 118.50 1ce8 h GLU 427 Ca 0.06 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 59.43 1ce8 h GLU 427 Cb 0.26 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.89 1ce8 h GLU 427 CO 0.00 0.11 -1.77 -0.07 -1.16 0.00 0.00 179.01 176.12 1ce8 h LEU 428 N 0.00 0.33 -0.00 1.33 4.07 -0.66 -3.34 115.31 117.04 1ce8 h LEU 428 Ca -0.00 -0.61 -0.23 0.00 0.08 0.00 0.00 57.88 57.11 1ce8 h LEU 428 Cb 0.27 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 41.89 1ce8 h LEU 428 CO 0.01 1.54 -1.07 0.50 -1.08 0.00 0.00 178.44 178.34 1ce8 h LYS 429 N 0.06 0.14 -3.10 1.13 3.64 -0.53 -3.35 116.57 114.56 1ce8 h LYS 429 Ca -0.33 -0.21 -0.60 0.00 -1.27 0.00 0.00 60.65 58.24 1ce8 h LYS 429 Cb 2.03 0.08 -0.40 0.00 -0.41 0.00 0.00 32.23 33.53 1ce8 h LYS 429 CO 0.12 1.07 -0.76 -0.51 -2.27 0.00 0.00 179.45 177.10 1ce8 s ASP 430 N -6.92 3.66 0.40 4.20 1.01 -0.11 -4.90 116.67 114.03 1ce8 s ASP 430 Ca -0.02 -2.25 -0.27 0.00 0.71 0.00 0.00 52.55 50.73 1ce8 s ASP 430 Cb 0.09 -0.88 -0.10 0.00 1.01 0.00 0.00 42.92 43.03 1ce8 s ASP 430 CO 0.85 -0.32 1.39 0.00 0.21 0.00 0.00 175.17 177.30 1ce8 n ALA 431 N 4.03 1.86 -4.39 5.23 0.00 -1.25 -4.48 120.51 121.51 1ce8 n ALA 431 Ca 0.06 0.30 -0.21 0.00 0.00 0.00 0.00 53.44 53.59 1ce8 n ALA 431 Cb 0.37 -2.35 -0.05 0.00 0.00 0.00 0.00 19.45 17.42 1ce8 n ALA 431 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ce8 n GLY 432 N 0.62 3.67 0.23 0.00 0.00 -1.26 -0.37 105.19 108.08 1ce8 n GLY 432 Ca 0.04 -2.22 0.15 0.00 0.00 0.00 0.00 46.02 43.98 1ce8 n GLY 432 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ce8 h ALA 433 N 1.28 1.00 -0.12 4.61 0.00 -1.97 -3.01 119.26 121.05 1ce8 h ALA 433 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1ce8 h ALA 433 Cb 0.86 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1ce8 h ALA 433 CO 0.43 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.43 1ce8 n ASP 434 N -2.92 2.47 -0.32 0.00 8.00 -1.26 -4.49 116.55 118.02 1ce8 n ASP 434 Ca 0.02 -1.82 0.14 0.00 0.71 0.00 0.00 54.79 53.84 1ce8 n ASP 434 Cb 0.37 -0.07 0.32 0.00 -0.02 0.00 0.00 41.12 41.73 1ce8 n ASP 434 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 1ce8 h ARG 435 N 3.62 0.52 -0.88 -1.24 2.43 -1.79 -0.38 114.38 116.67 1ce8 h ARG 435 Ca 0.00 -0.03 0.12 0.00 -0.81 0.00 0.00 59.98 59.26 1ce8 h ARG 435 Cb 0.78 -0.12 -0.08 0.00 -0.42 0.00 0.00 29.97 30.13 1ce8 h ARG 435 CO 0.00 0.34 0.50 0.97 -1.51 0.00 0.00 179.97 180.28 1ce8 h ILE 436 N 0.54 0.86 -0.22 1.20 6.09 -1.85 -0.77 117.51 123.35 1ce8 h ILE 436 Ca 0.58 -0.27 -0.16 0.00 -1.37 0.00 0.00 64.86 63.64 1ce8 h ILE 436 Cb 1.03 -0.00 -0.01 0.00 0.47 0.00 0.00 36.82 38.32 1ce8 h ILE 436 CO -0.47 0.14 -0.51 -0.50 -3.07 0.00 0.00 178.15 173.75 1ce8 h TRP 437 N 0.79 0.75 0.00 2.19 6.55 -1.41 -2.88 115.95 121.94 1ce8 h TRP 437 Ca 0.44 -0.25 -0.02 0.00 0.95 0.00 0.00 58.89 60.01 1ce8 h TRP 437 Cb 0.49 -0.15 -0.00 0.00 -0.86 0.00 0.00 29.16 28.63 1ce8 h TRP 437 CO -0.05 0.99 -0.09 1.88 -1.05 0.00 0.00 178.44 180.12 1ce8 h TYR 438 N 0.48 0.00 -0.31 0.49 0.05 -0.93 -1.52 116.97 115.23 1ce8 h TYR 438 Ca 0.02 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.70 1ce8 h TYR 438 Cb 1.05 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.78 1ce8 h TYR 438 CO 0.05 0.09 -0.20 0.82 -1.05 0.00 0.00 178.16 177.86 1ce8 h ILE 439 N 0.00 1.30 -0.47 -2.88 2.04 -0.96 0.91 117.51 117.45 1ce8 h ILE 439 Ca -0.00 -1.33 -0.07 0.00 1.00 0.00 0.00 64.86 64.46 1ce8 h ILE 439 Cb 0.30 1.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 1ce8 h ILE 439 CO 0.01 0.43 0.02 0.00 0.00 0.00 0.00 178.15 178.61 1ce8 h ALA 440 N 0.74 0.63 -0.99 1.87 0.00 -1.51 -2.11 119.26 117.90 1ce8 h ALA 440 Ca 0.06 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.72 1ce8 h ALA 440 Cb 0.75 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.31 1ce8 h ALA 440 CO 0.06 0.41 0.65 -0.44 0.00 0.00 0.00 179.25 179.93 1ce8 h ASP 441 N 0.67 1.13 -0.70 0.00 3.32 -1.08 -0.79 116.42 118.96 1ce8 h ASP 441 Ca 0.14 -0.03 0.06 0.00 0.02 0.00 0.00 57.03 57.22 1ce8 h ASP 441 Cb 0.47 -0.28 -0.06 0.00 0.22 0.00 0.00 39.33 39.68 1ce8 h ASP 441 CO 0.02 0.81 0.40 0.00 -1.72 0.00 0.00 179.24 178.75 1ce8 h ALA 442 N 1.39 0.94 -0.16 3.45 0.00 -0.16 0.18 119.26 124.90 1ce8 h ALA 442 Ca 0.37 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.17 1ce8 h ALA 442 Cb -0.14 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1ce8 h ALA 442 CO -0.08 0.09 -0.41 0.74 0.00 0.00 0.00 179.25 179.59 1ce8 h PHE 443 N 0.74 0.42 -0.16 0.00 0.04 -0.95 0.21 116.94 117.24 1ce8 h PHE 443 Ca 0.31 -0.12 -0.01 0.00 2.80 0.00 0.00 57.97 60.96 1ce8 h PHE 443 Cb 0.17 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.23 1ce8 h PHE 443 CO -0.07 0.71 0.07 0.00 -0.60 0.00 0.00 178.31 178.42 1ce8 h ARG 444 N 0.29 0.23 0.00 1.51 3.08 -0.05 -2.47 114.38 116.98 1ce8 h ARG 444 Ca 0.03 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1ce8 h ARG 444 Cb 0.85 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.86 1ce8 h ARG 444 CO 0.07 0.29 0.00 0.00 -1.07 0.00 0.00 179.97 179.26 1ce8 n ALA 445 N -2.21 2.08 -0.70 0.04 0.00 0.52 -4.85 120.51 115.39 1ce8 n ALA 445 Ca -0.05 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1ce8 n ALA 445 Cb 0.11 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.46 1ce8 n ALA 445 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ce8 n GLY 446 N 0.06 0.62 3.84 0.00 0.00 -0.93 -5.04 105.19 103.75 1ce8 n GLY 446 Ca 0.05 -0.27 -0.32 0.00 0.00 0.00 0.00 46.02 45.47 1ce8 n GLY 446 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ce8 s LEU 447 N 0.00 3.93 0.48 0.99 1.43 0.71 -5.00 118.68 121.23 1ce8 s LEU 447 Ca 0.00 1.41 -0.04 0.00 -1.03 0.00 0.00 54.13 54.48 1ce8 s LEU 447 Cb 0.00 -4.26 -0.02 0.00 0.03 0.00 0.00 46.19 41.94 1ce8 s LEU 447 CO 0.00 -0.33 0.76 -0.94 0.23 0.00 0.00 176.35 176.07 1ce8 s SER 448 N -2.50 6.03 0.21 2.29 1.04 -1.26 -4.44 113.70 115.08 1ce8 s SER 448 Ca 0.57 0.70 -0.09 0.00 0.48 0.00 0.00 55.95 57.61 1ce8 s SER 448 Cb -0.10 -1.96 0.25 0.00 0.10 0.00 0.00 66.02 64.31 1ce8 s SER 448 CO 0.20 -0.68 1.81 0.58 0.98 0.00 0.00 173.24 176.13 1ce8 h VAL 449 N 0.23 0.97 -0.34 5.02 2.07 -1.97 0.61 116.25 122.85 1ce8 h VAL 449 Ca -0.47 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 1ce8 h VAL 449 Cb 1.23 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 1ce8 h VAL 449 CO 0.61 0.13 0.20 0.44 0.02 0.00 0.00 177.57 178.97 1ce8 h ASP 450 N 0.71 0.41 -0.75 0.57 3.32 -1.99 0.52 116.42 119.21 1ce8 h ASP 450 Ca 0.31 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 1ce8 h ASP 450 Cb 0.19 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.60 1ce8 h ASP 450 CO -0.18 0.34 0.43 1.23 -1.72 0.00 0.00 179.24 179.34 1ce8 h GLY 451 N 0.44 1.11 1.07 2.75 0.00 -1.67 0.11 103.07 106.88 1ce8 h GLY 451 Ca 0.12 -0.49 -0.05 0.00 0.00 0.00 0.00 47.33 46.91 1ce8 h GLY 451 CO -0.02 0.47 0.28 -2.08 0.00 0.00 0.00 176.54 175.19 1ce8 h VAL 452 N 1.04 1.26 -0.25 4.60 2.07 -0.54 -2.53 116.25 121.89 1ce8 h VAL 452 Ca 0.27 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 66.91 1ce8 h VAL 452 Cb 0.01 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.14 1ce8 h VAL 452 CO -0.05 0.35 0.11 0.15 0.02 0.00 0.00 177.57 178.15 1ce8 h PHE 453 N 1.14 0.38 -0.09 1.57 3.57 -0.42 0.11 116.94 123.19 1ce8 h PHE 453 Ca 0.25 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.75 1ce8 h PHE 453 Cb 0.26 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.88 1ce8 h PHE 453 CO 0.02 0.38 0.07 -0.91 -2.23 0.00 0.00 178.31 175.64 1ce8 h ASN 454 N 0.26 0.00 0.25 0.41 2.35 -0.63 0.29 115.58 118.51 1ce8 h ASN 454 Ca 0.09 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.49 1ce8 h ASN 454 Cb 0.16 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 1ce8 h ASN 454 CO -0.01 0.00 -1.77 -0.07 -1.65 0.00 0.00 177.43 173.93 1ce8 h LEU 455 N 0.00 0.47 0.00 1.61 3.38 -1.05 -3.41 115.31 116.31 1ce8 h LEU 455 Ca 0.04 -0.79 -0.33 0.00 0.09 0.00 0.00 57.88 56.89 1ce8 h LEU 455 Cb 0.18 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.71 1ce8 h LEU 455 CO -0.00 1.68 -2.07 0.35 0.09 0.00 0.00 178.44 178.49 1ce8 n THR 456 N -3.49 1.48 -1.03 0.22 -2.24 -0.01 -4.31 114.28 104.89 1ce8 n THR 456 Ca -0.24 -0.83 -0.01 0.00 -2.27 0.00 0.00 64.05 60.70 1ce8 n THR 456 Cb 1.06 -0.72 -0.01 0.00 -2.10 0.00 0.00 70.33 68.56 1ce8 n THR 456 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1ce8 n ASN 457 N -2.88 -3.89 -4.67 3.42 5.03 0.99 -4.68 115.26 108.59 1ce8 n ASN 457 Ca -0.25 0.03 -0.43 0.00 0.87 0.00 0.00 54.58 54.80 1ce8 n ASN 457 Cb 1.11 -1.50 -0.02 0.00 -1.02 0.00 0.00 39.78 38.35 1ce8 n ASN 457 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1ce8 s ILE 458 N -1.79 4.62 -0.04 2.41 1.01 -1.26 -4.60 121.20 121.54 1ce8 s ILE 458 Ca 0.00 1.94 -0.40 0.00 0.00 0.00 0.00 60.65 62.19 1ce8 s ILE 458 Cb 0.00 -4.25 -0.20 0.00 0.01 0.00 0.00 42.46 38.02 1ce8 s ILE 458 CO 0.00 -0.14 1.09 -0.67 0.00 0.00 0.00 174.94 175.22 1ce8 n ASP 459 N 6.12 0.09 0.01 3.58 -0.08 -1.26 -4.72 116.55 120.29 1ce8 n ASP 459 Ca 0.12 1.14 0.20 0.00 -1.51 0.00 0.00 54.79 54.74 1ce8 n ASP 459 Cb 0.46 -0.90 0.71 0.00 2.34 0.00 0.00 41.12 43.73 1ce8 n ASP 459 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 1ce8 h ARG 460 N 3.09 0.00 -0.98 -0.67 3.08 -1.95 0.72 114.38 117.67 1ce8 h ARG 460 Ca -0.49 0.00 0.17 0.00 0.07 0.00 0.00 59.98 59.73 1ce8 h ARG 460 Cb 1.39 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.35 1ce8 h ARG 460 CO 0.66 0.00 0.61 2.35 -1.07 0.00 0.00 179.97 182.52 1ce8 h TRP 461 N 0.00 0.97 0.03 3.04 7.01 -2.01 0.21 115.95 125.21 1ce8 h TRP 461 Ca 0.24 0.03 -0.06 0.00 2.11 0.00 0.00 58.89 61.22 1ce8 h TRP 461 Cb 1.02 -0.30 0.01 0.00 -2.10 0.00 0.00 29.16 27.79 1ce8 h TRP 461 CO 0.00 0.27 -0.25 0.74 -2.79 0.00 0.00 178.44 176.42 1ce8 h PHE 462 N 0.75 0.19 -0.82 2.65 0.04 -1.20 -3.33 116.94 115.22 1ce8 h PHE 462 Ca 0.53 -0.13 0.08 0.00 2.80 0.00 0.00 57.97 61.26 1ce8 h PHE 462 Cb 0.84 -0.01 -0.07 0.00 2.20 0.00 0.00 35.95 38.91 1ce8 h PHE 462 CO -0.00 1.03 0.48 -0.07 -0.60 0.00 0.00 178.31 179.15 1ce8 h LEU 463 N -0.70 0.71 -1.04 1.54 3.38 -1.07 -1.82 115.31 116.31 1ce8 h LEU 463 Ca -0.04 0.04 0.08 0.00 0.09 0.00 0.00 57.88 58.05 1ce8 h LEU 463 Cb 1.12 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 41.70 1ce8 h LEU 463 CO 0.05 0.42 0.63 -0.37 0.09 0.00 0.00 178.44 179.26 1ce8 h VAL 464 N 0.83 1.04 -0.27 1.22 -1.51 -0.74 0.06 116.25 116.88 1ce8 h VAL 464 Ca 0.39 -0.38 -0.07 0.00 -1.23 0.00 0.00 66.70 65.41 1ce8 h VAL 464 Cb 0.31 -0.16 -0.02 0.00 -2.13 0.00 0.00 31.29 29.29 1ce8 h VAL 464 CO -0.22 0.20 -0.12 1.56 -1.23 0.00 0.00 177.57 177.76 1ce8 h GLN 465 N 1.10 0.45 -0.07 5.19 4.20 -1.43 -0.68 115.11 123.87 1ce8 h GLN 465 Ca 0.44 -0.12 -0.05 0.00 0.06 0.00 0.00 58.65 58.98 1ce8 h GLN 465 Cb 0.26 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.99 1ce8 h GLN 465 CO -0.19 0.57 -0.14 0.82 -0.67 0.00 0.00 178.83 179.23 1ce8 h ILE 466 N 0.42 1.41 -0.62 2.54 2.04 -1.27 -2.25 117.51 119.79 1ce8 h ILE 466 Ca 0.08 -1.44 0.11 0.00 1.00 0.00 0.00 64.86 64.62 1ce8 h ILE 466 Cb 0.46 2.19 -0.08 0.00 -0.74 0.00 0.00 36.82 38.65 1ce8 h ILE 466 CO 0.03 0.40 0.18 -0.08 0.00 0.00 0.00 178.15 178.68 1ce8 h GLU 467 N -0.26 0.31 -0.73 2.37 4.81 -0.55 0.76 114.58 121.29 1ce8 h GLU 467 Ca 0.00 -0.02 0.06 0.00 -0.13 0.00 0.00 59.36 59.27 1ce8 h GLU 467 Cb 0.72 -0.07 -0.06 0.00 0.63 0.00 0.00 28.75 29.97 1ce8 h GLU 467 CO 0.03 0.21 0.43 1.49 -0.73 0.00 0.00 179.01 180.44 1ce8 h GLU 468 N 0.32 0.77 -0.67 1.92 4.81 -1.04 -1.63 114.58 119.06 1ce8 h GLU 468 Ca 0.33 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 59.55 1ce8 h GLU 468 Cb 0.47 -0.17 -0.05 0.00 0.63 0.00 0.00 28.75 29.63 1ce8 h GLU 468 CO -0.38 0.51 0.40 -0.07 -0.73 0.00 0.00 179.01 178.74 1ce8 h LEU 469 N 0.79 0.63 -0.58 1.64 3.38 -0.30 -1.11 115.31 119.76 1ce8 h LEU 469 Ca 0.32 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.33 1ce8 h LEU 469 Cb 0.16 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1ce8 h LEU 469 CO -0.17 0.42 0.35 0.58 0.09 0.00 0.00 178.44 179.71 1ce8 h VAL 470 N 0.76 1.05 0.22 1.22 2.07 -0.19 0.11 116.25 121.49 1ce8 h VAL 470 Ca 0.28 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 1ce8 h VAL 470 Cb 0.09 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 30.17 1ce8 h VAL 470 CO -0.14 0.12 -0.11 0.03 0.02 0.00 0.00 177.57 177.50 1ce8 h ARG 471 N 0.68 -0.29 -0.90 1.57 2.47 -0.77 -0.06 114.38 117.08 1ce8 h ARG 471 Ca 0.24 0.02 0.15 0.00 -1.26 0.00 0.00 59.98 59.13 1ce8 h ARG 471 Cb 0.04 0.07 -0.09 0.00 -1.65 0.00 0.00 29.97 28.33 1ce8 h ARG 471 CO -0.11 -0.14 0.50 -0.07 0.56 0.00 0.00 179.97 180.71 1ce8 h LEU 472 N -0.36 0.64 -0.54 3.04 3.38 -0.95 0.42 115.31 120.94 1ce8 h LEU 472 Ca -0.03 0.09 0.08 0.00 0.09 0.00 0.00 57.88 58.11 1ce8 h LEU 472 Cb 0.28 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 40.93 1ce8 h LEU 472 CO 0.05 0.28 0.18 -0.33 0.09 0.00 0.00 178.44 178.70 1ce8 h GLU 473 N 0.71 0.34 -0.30 1.13 5.08 -0.03 -1.67 114.58 119.84 1ce8 h GLU 473 Ca 0.49 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.79 1ce8 h GLU 473 Cb 0.67 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 1ce8 h GLU 473 CO -0.35 0.22 -0.00 0.93 -1.00 0.00 0.00 179.01 178.81 1ce8 h GLU 474 N 0.35 0.46 -0.07 2.33 5.08 0.17 -1.91 114.58 120.98 1ce8 h GLU 474 Ca 0.27 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 1ce8 h GLU 474 Cb 0.33 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 1ce8 h GLU 474 CO -0.29 0.49 -0.05 -0.22 -1.00 0.00 0.00 179.01 177.94 1ce8 h LYS 475 N 0.44 0.15 -0.43 2.33 3.64 -0.34 -2.47 116.57 119.89 1ce8 h LYS 475 Ca 0.10 -0.07 0.09 0.00 -1.27 0.00 0.00 60.65 59.49 1ce8 h LYS 475 Cb 0.29 -0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.02 1ce8 h LYS 475 CO 0.01 0.55 -0.20 0.28 -2.27 0.00 0.00 179.45 177.83 1ce8 h VAL 476 N -0.25 0.41 -0.28 2.00 2.07 -1.04 0.22 116.25 119.38 1ce8 h VAL 476 Ca 0.01 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.57 1ce8 h VAL 476 Cb 0.51 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1ce8 h VAL 476 CO 0.01 0.00 0.19 0.00 0.02 0.00 0.00 177.57 177.79 1ce8 h ALA 477 N 1.20 1.95 0.25 1.67 0.00 -1.39 0.57 119.26 123.52 1ce8 h ALA 477 Ca 0.21 -0.01 -0.34 0.00 0.00 0.00 0.00 54.91 54.76 1ce8 h ALA 477 Cb 0.43 -0.06 0.04 0.00 0.00 0.00 0.00 17.79 18.19 1ce8 h ALA 477 CO -0.50 0.00 -1.52 1.49 0.00 0.00 0.00 179.25 178.72 1ce8 h GLU 478 N 0.25 0.53 0.13 0.00 4.57 -0.27 -3.37 114.58 116.41 1ce8 h GLU 478 Ca 0.12 -0.90 -0.28 0.00 -1.18 0.00 0.00 59.36 57.12 1ce8 h GLU 478 Cb 0.16 0.33 0.00 0.00 -0.16 0.00 0.00 28.75 29.09 1ce8 h GLU 478 CO -0.02 1.43 -1.29 -0.39 -1.18 0.00 0.00 179.01 177.55 1ce8 h VAL 479 N 0.14 1.44 -0.24 0.32 -1.51 -0.31 -3.51 116.25 112.59 1ce8 h VAL 479 Ca -0.27 -3.01 0.03 0.00 -1.23 0.00 0.00 66.70 62.21 1ce8 h VAL 479 Cb 2.17 2.93 -0.01 0.00 -2.13 0.00 0.00 31.29 34.24 1ce8 h VAL 479 CO 0.26 0.88 -0.05 0.61 -1.23 0.00 0.00 177.57 178.05 1ce8 n GLY 480 N 1.56 -1.56 0.36 5.19 0.00 0.16 -3.31 105.19 107.58 1ce8 n GLY 480 Ca -0.10 -1.50 0.18 0.00 0.00 0.00 0.00 46.02 44.60 1ce8 n GLY 480 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1ce8 h ILE 481 N -0.10 0.19 -0.26 -0.61 2.10 -1.85 0.47 117.51 117.45 1ce8 h ILE 481 Ca -0.00 0.00 -0.13 0.00 1.08 0.00 0.00 64.86 65.81 1ce8 h ILE 481 Cb 0.10 0.69 -0.01 0.00 -1.09 0.00 0.00 36.82 36.51 1ce8 h ILE 481 CO 0.00 0.00 -0.38 0.71 -1.08 0.00 0.00 178.15 177.40 1ce8 h THR 482 N 0.00 1.29 0.00 2.19 1.35 -1.95 -2.35 112.91 113.44 1ce8 h THR 482 Ca 0.08 -1.53 0.00 0.00 -0.55 0.00 0.00 66.41 64.41 1ce8 h THR 482 Cb 0.78 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.70 1ce8 h THR 482 CO -0.00 0.49 0.00 1.23 -0.25 0.00 0.00 175.52 176.99 1ce8 h GLY 483 N 1.02 0.00 -6.89 5.82 0.00 -0.05 -3.39 103.07 99.58 1ce8 h GLY 483 Ca 0.05 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 46.76 1ce8 h GLY 483 CO 0.08 0.00 2.30 1.04 0.00 0.00 0.00 176.54 179.95 1ce8 n LEU 484 N -2.88 4.96 -4.91 3.11 4.77 -0.89 -4.90 117.00 116.26 1ce8 n LEU 484 Ca 0.01 -3.60 -0.27 0.00 -0.03 0.00 0.00 56.01 52.12 1ce8 n LEU 484 Cb 0.26 -1.57 0.04 0.00 -2.33 0.00 0.00 43.42 39.82 1ce8 n LEU 484 CO 0.25 -0.06 0.57 0.54 -1.33 0.00 0.00 177.39 177.36 1ce8 s ASN 485 N 4.53 5.50 0.16 -1.43 2.20 -1.26 -4.80 114.94 119.83 1ce8 s ASN 485 Ca 0.55 0.75 -0.17 0.00 -0.94 0.00 0.00 52.86 53.05 1ce8 s ASN 485 Cb 0.09 -1.68 0.07 0.00 -2.00 0.00 0.00 41.25 37.73 1ce8 s ASN 485 CO 0.05 -1.15 1.72 0.00 -2.94 0.00 0.00 177.10 174.77 1ce8 h ALA 486 N -0.28 0.34 0.00 3.54 0.00 -1.98 0.12 119.26 120.99 1ce8 h ALA 486 Ca -0.45 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 1ce8 h ALA 486 Cb 1.26 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.18 1ce8 h ALA 486 CO 0.61 -0.37 -0.09 -0.44 0.00 0.00 0.00 179.25 178.95 1ce8 h ASP 487 N 0.14 0.00 0.13 0.00 3.32 -1.97 -2.23 116.42 115.81 1ce8 h ASP 487 Ca 0.17 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.86 1ce8 h ASP 487 Cb 0.21 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.71 1ce8 h ASP 487 CO -0.25 0.09 -2.19 0.33 -1.72 0.00 0.00 179.24 175.50 1ce8 n PHE 488 N -3.43 0.45 -0.06 4.55 7.35 -0.82 -3.51 117.46 121.99 1ce8 n PHE 488 Ca -0.01 0.13 -0.07 0.00 -0.76 0.00 0.00 57.45 56.74 1ce8 n PHE 488 Cb 0.25 -1.07 0.12 0.00 0.35 0.00 0.00 39.48 39.13 1ce8 n PHE 488 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 1ce8 h LEU 489 N 0.01 0.71 -1.31 -2.13 5.85 -0.77 -2.03 115.31 115.63 1ce8 h LEU 489 Ca -0.48 -0.25 -0.06 0.00 0.84 0.00 0.00 57.88 57.94 1ce8 h LEU 489 Cb 2.07 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.89 1ce8 h LEU 489 CO 0.02 0.92 -0.15 -0.09 -0.34 0.00 0.00 178.44 178.81 1ce8 h ARG 490 N 0.61 0.28 0.49 1.25 2.43 -1.54 -1.53 114.38 116.38 1ce8 h ARG 490 Ca 0.09 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 1ce8 h ARG 490 Cb 0.71 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 1ce8 h ARG 490 CO 0.05 0.43 -0.24 0.37 -1.51 0.00 0.00 179.97 179.08 1ce8 h GLN 491 N 0.27 -0.63 -0.91 0.20 4.15 -1.49 -0.77 115.11 115.92 1ce8 h GLN 491 Ca 0.05 0.04 0.08 0.00 0.77 0.00 0.00 58.65 59.60 1ce8 h GLN 491 Cb 0.42 0.14 -0.06 0.00 0.21 0.00 0.00 27.48 28.19 1ce8 h GLN 491 CO 0.03 -0.35 0.59 -0.07 -1.93 0.00 0.00 178.83 177.09 1ce8 h LEU 492 N -0.82 0.87 0.05 -2.39 3.38 -1.16 -1.60 115.31 113.63 1ce8 h LEU 492 Ca -0.07 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1ce8 h LEU 492 Cb 0.57 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1ce8 h LEU 492 CO 0.11 0.53 -0.02 0.11 0.09 0.00 0.00 178.44 179.26 1ce8 h LYS 493 N 0.97 -0.07 0.00 1.13 1.79 -1.21 -0.13 116.57 119.05 1ce8 h LYS 493 Ca 0.41 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.88 1ce8 h LYS 493 Cb 0.31 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.97 1ce8 h LYS 493 CO -0.17 0.19 0.12 0.00 -1.08 0.00 0.00 179.45 178.51 1ce8 h ARG 494 N -0.31 0.00 -0.01 3.15 3.08 -0.46 0.46 114.38 120.29 1ce8 h ARG 494 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1ce8 h ARG 494 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1ce8 h ARG 494 CO 0.01 0.00 -0.17 1.63 -1.07 0.00 0.00 179.97 180.37 1ce8 n LYS 495 N -2.77 0.98 -0.24 0.04 4.76 -0.67 -4.48 118.16 115.78 1ce8 n LYS 495 Ca -0.02 -0.53 0.00 0.00 -2.87 0.00 0.00 58.31 54.89 1ce8 n LYS 495 Cb 0.17 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.87 1ce8 n LYS 495 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ce8 n GLY 496 N 1.29 0.64 3.72 0.72 0.00 0.16 -3.34 105.19 108.38 1ce8 n GLY 496 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1ce8 n GLY 496 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ce8 n PHE 497 N -2.02 2.74 -3.24 1.61 3.72 -0.12 -4.38 117.46 115.78 1ce8 n PHE 497 Ca 0.00 0.08 -0.34 0.00 -0.05 0.00 0.00 57.45 57.15 1ce8 n PHE 497 Cb 0.00 -2.66 -0.06 0.00 -0.94 0.00 0.00 39.48 35.82 1ce8 n PHE 497 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ce8 s ALA 498 N 0.99 3.45 0.15 4.37 0.00 -1.26 -4.52 121.76 124.93 1ce8 s ALA 498 Ca 0.74 -0.04 -0.21 0.00 0.00 0.00 0.00 51.96 52.44 1ce8 s ALA 498 Cb -0.51 -2.65 0.02 0.00 0.00 0.00 0.00 23.12 19.98 1ce8 s ALA 498 CO 0.35 0.40 1.65 -0.44 0.00 0.00 0.00 175.76 177.72 1ce8 h ASP 499 N 2.82 -0.56 -0.27 0.00 5.19 -1.93 0.18 116.42 121.85 1ce8 h ASP 499 Ca -0.48 0.11 0.08 0.00 -0.62 0.00 0.00 57.03 56.12 1ce8 h ASP 499 Cb 1.18 0.28 -0.01 0.00 0.18 0.00 0.00 39.33 40.96 1ce8 h ASP 499 CO 0.66 -0.21 0.20 0.00 -3.12 0.00 0.00 179.24 176.77 1ce8 h ALA 500 N 0.96 2.20 -0.00 3.45 0.00 -1.92 0.28 119.26 124.22 1ce8 h ALA 500 Ca 0.13 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1ce8 h ALA 500 Cb 0.37 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1ce8 h ALA 500 CO -0.33 -0.34 -0.24 -0.09 0.00 0.00 0.00 179.25 178.25 1ce8 h ARG 501 N 0.00 0.17 -0.82 0.00 9.65 -0.97 -2.75 114.38 119.67 1ce8 h ARG 501 Ca 0.13 -0.18 -0.02 0.00 -1.10 0.00 0.00 59.98 58.81 1ce8 h ARG 501 Cb 0.52 0.05 -0.04 0.00 -1.39 0.00 0.00 29.97 29.12 1ce8 h ARG 501 CO -0.00 0.91 0.41 -0.07 2.80 0.00 0.00 179.97 184.02 1ce8 h LEU 502 N -0.50 1.05 -0.29 3.80 3.38 -0.49 -2.70 115.31 119.56 1ce8 h LEU 502 Ca -0.03 -0.12 0.05 0.00 0.09 0.00 0.00 57.88 57.87 1ce8 h LEU 502 Cb 0.99 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.42 1ce8 h LEU 502 CO 0.05 0.88 0.02 0.00 0.09 0.00 0.00 178.44 179.48 1ce8 h ALA 503 N 1.22 0.28 -0.32 1.53 0.00 -0.48 0.35 119.26 121.85 1ce8 h ALA 503 Ca 0.28 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.21 1ce8 h ALA 503 Cb 0.09 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1ce8 h ALA 503 CO -0.04 -0.39 -0.04 0.87 0.00 0.00 0.00 179.25 179.65 1ce8 h LYS 504 N 0.12 0.51 -0.10 0.00 1.57 -1.20 -1.73 116.57 115.74 1ce8 h LYS 504 Ca 0.14 -0.12 -0.13 0.00 -1.87 0.00 0.00 60.65 58.67 1ce8 h LYS 504 Cb 0.17 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1ce8 h LYS 504 CO -0.21 0.56 -0.52 -0.07 -0.57 0.00 0.00 179.45 178.64 1ce8 h LEU 505 N 0.48 0.29 -1.72 2.94 3.38 -0.97 -3.14 115.31 116.57 1ce8 h LEU 505 Ca 0.10 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1ce8 h LEU 505 Cb 0.38 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1ce8 h LEU 505 CO 0.02 0.76 0.00 0.00 0.09 0.00 0.00 178.44 179.31 1ce8 n ALA 506 N -2.47 2.48 -3.39 1.53 0.00 0.01 -4.08 120.51 114.58 1ce8 n ALA 506 Ca -0.02 -0.70 -0.18 0.00 0.00 0.00 0.00 53.44 52.54 1ce8 n ALA 506 Cb 0.56 -0.94 0.08 0.00 0.00 0.00 0.00 19.45 19.15 1ce8 n ALA 506 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ce8 n GLY 507 N 1.33 -0.35 0.16 0.00 0.00 -0.69 -4.12 105.19 101.52 1ce8 n GLY 507 Ca 0.17 0.10 -0.01 0.00 0.00 0.00 0.00 46.02 46.28 1ce8 n GLY 507 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1ce8 n VAL 508 N -4.19 0.00 -3.71 1.61 0.24 -0.95 -5.05 118.33 106.28 1ce8 n VAL 508 Ca -0.20 -0.12 -0.31 0.00 -2.04 0.00 0.00 64.34 61.67 1ce8 n VAL 508 Cb 0.63 0.05 -0.05 0.00 -1.47 0.00 0.00 33.84 33.00 1ce8 n VAL 508 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1ce8 s ARG 509 N -2.07 3.59 0.53 7.34 0.52 -1.26 -4.51 118.95 123.08 1ce8 s ARG 509 Ca 0.01 -0.15 0.20 0.00 -0.52 0.00 0.00 55.73 55.27 1ce8 s ARG 509 Cb 0.00 -2.88 1.35 0.00 0.52 0.00 0.00 34.95 33.94 1ce8 s ARG 509 CO 0.01 0.49 2.10 1.49 0.02 0.00 0.00 175.30 179.41 1ce8 h GLU 510 N 2.86 0.00 0.00 3.54 4.81 -1.90 0.26 114.58 124.15 1ce8 h GLU 510 Ca -0.46 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.71 1ce8 h GLU 510 Cb 1.16 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.53 1ce8 h GLU 510 CO 0.73 0.00 -0.31 0.00 -0.73 0.00 0.00 179.01 178.70 1ce8 h ALA 511 N 1.91 1.44 -0.47 2.92 0.00 -1.93 -2.40 119.26 120.73 1ce8 h ALA 511 Ca 0.08 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 1ce8 h ALA 511 Cb 0.33 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1ce8 h ALA 511 CO -0.00 0.39 -0.19 0.93 0.00 0.00 0.00 179.25 180.38 1ce8 h GLU 512 N 0.00 0.96 -0.33 0.00 5.08 -1.33 0.56 114.58 119.52 1ce8 h GLU 512 Ca -0.00 -0.40 -0.17 0.00 -1.00 0.00 0.00 59.36 57.79 1ce8 h GLU 512 Cb 0.56 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 1ce8 h GLU 512 CO 0.04 1.07 -0.45 0.82 -1.00 0.00 0.00 179.01 179.50 1ce8 h ILE 513 N 0.81 1.28 -0.27 3.13 1.08 -1.34 -0.76 117.51 121.43 1ce8 h ILE 513 Ca 0.11 -1.63 -0.00 0.00 -0.39 0.00 0.00 64.86 62.95 1ce8 h ILE 513 Cb 0.76 1.49 -0.01 0.00 -3.07 0.00 0.00 36.82 35.99 1ce8 h ILE 513 CO 0.06 0.54 0.15 -0.09 -0.69 0.00 0.00 178.15 178.12 1ce8 h ARG 514 N 0.69 0.37 -0.67 2.37 2.43 -1.24 0.38 114.38 118.72 1ce8 h ARG 514 Ca 0.04 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1ce8 h ARG 514 Cb 1.04 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.48 1ce8 h ARG 514 CO 0.10 0.32 0.44 0.87 -1.51 0.00 0.00 179.97 180.20 1ce8 h LYS 515 N 0.32 0.87 -0.17 0.20 1.57 -0.82 0.37 116.57 118.91 1ce8 h LYS 515 Ca 0.09 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 58.87 1ce8 h LYS 515 Cb 0.06 -0.20 -0.05 0.00 0.08 0.00 0.00 32.23 32.13 1ce8 h LYS 515 CO -0.02 0.57 -0.12 1.25 -0.57 0.00 0.00 179.45 180.57 1ce8 h LEU 516 N 0.89 -0.39 -0.83 2.94 5.85 -0.56 -1.78 115.31 121.42 1ce8 h LEU 516 Ca 0.25 0.08 0.02 0.00 0.84 0.00 0.00 57.88 59.07 1ce8 h LEU 516 Cb -0.09 0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 1ce8 h LEU 516 CO -0.06 -0.16 0.55 0.03 -0.34 0.00 0.00 178.44 178.46 1ce8 h ARG 517 N -0.13 1.06 -0.59 1.25 3.08 0.71 -2.87 114.38 116.89 1ce8 h ARG 517 Ca 0.10 -0.06 0.11 0.00 0.07 0.00 0.00 59.98 60.20 1ce8 h ARG 517 Cb 0.28 -0.24 -0.09 0.00 0.08 0.00 0.00 29.97 30.00 1ce8 h ARG 517 CO -0.25 0.70 0.08 -0.44 -1.07 0.00 0.00 179.97 179.00 1ce8 h ASP 518 N 1.10 -0.09 0.12 7.04 3.32 -0.25 -0.51 116.42 127.14 1ce8 h ASP 518 Ca 0.32 0.12 -0.02 0.00 0.02 0.00 0.00 57.03 57.47 1ce8 h ASP 518 Cb -0.08 0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.66 1ce8 h ASP 518 CO -0.09 -0.03 -0.08 -0.61 -1.72 0.00 0.00 179.24 176.71 1ce8 h GLN 519 N 0.20 0.00 -0.01 3.56 4.15 -1.13 -2.13 115.11 119.75 1ce8 h GLN 519 Ca 0.31 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.73 1ce8 h GLN 519 Cb 0.47 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.16 1ce8 h GLN 519 CO -0.43 0.08 -0.32 0.66 -1.93 0.00 0.00 178.83 176.89 1ce8 n TYR 520 N -4.18 0.00 -2.95 3.99 4.01 -0.28 -4.91 117.16 112.85 1ce8 n TYR 520 Ca -0.03 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.49 1ce8 n TYR 520 Cb 0.16 -0.08 0.03 0.00 -0.31 0.00 0.00 39.34 39.14 1ce8 n TYR 520 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1ce8 n ASP 521 N -0.39 -5.92 -4.35 7.72 2.03 -0.80 -4.90 116.55 109.94 1ce8 n ASP 521 Ca 0.11 -0.25 -0.46 0.00 0.52 0.00 0.00 54.79 54.72 1ce8 n ASP 521 Cb 0.39 -4.81 -0.03 0.00 -0.72 0.00 0.00 41.12 35.95 1ce8 n ASP 521 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1ce8 s LEU 522 N -6.57 6.31 0.23 -2.67 2.96 -0.73 -5.02 118.68 113.19 1ce8 s LEU 522 Ca 0.26 -2.38 0.04 0.00 -0.22 0.00 0.00 54.13 51.83 1ce8 s LEU 522 Cb -0.12 -2.25 -0.05 0.00 0.50 0.00 0.00 46.19 44.27 1ce8 s LEU 522 CO 0.32 -0.73 -0.01 -1.00 -1.32 0.00 0.00 176.35 173.62 1ce8 s HIS 523 N 0.94 1.55 0.65 5.38 3.76 -1.26 -4.60 115.29 121.72 1ce8 s HIS 523 Ca 0.18 -0.91 -0.09 0.00 -0.15 0.00 0.00 55.06 54.09 1ce8 s HIS 523 Cb -0.13 -0.90 0.01 0.00 1.11 0.00 0.00 32.58 32.68 1ce8 s HIS 523 CO -0.06 -0.03 1.01 -1.25 -0.85 0.00 0.00 174.74 173.55 1ce8 s PRO 524 N -3.85 2.84 0.48 8.40 0.04 -1.26 -4.80 135.00 136.85 1ce8 s PRO 524 Ca 0.28 0.21 0.05 0.00 0.04 0.00 0.00 61.00 61.58 1ce8 s PRO 524 Cb 0.05 -2.14 -0.01 0.00 0.04 0.00 0.00 34.50 32.44 1ce8 s PRO 524 CO 0.08 -0.90 0.18 0.14 0.04 0.00 0.00 177.00 176.55 1ce8 s VAL 525 N -3.19 1.73 -0.10 -0.36 -7.23 0.42 -4.89 120.40 106.77 1ce8 s VAL 525 Ca 0.56 -1.74 0.03 0.00 -1.81 0.00 0.00 61.98 59.02 1ce8 s VAL 525 Cb -0.11 -2.47 0.01 0.00 0.56 0.00 0.00 36.38 34.37 1ce8 s VAL 525 CO 0.48 0.00 -0.19 -0.31 -0.31 0.00 0.00 175.10 174.77 1ce8 s TYR 526 N -2.75 2.22 0.29 2.82 1.51 -1.26 -2.37 117.35 117.81 1ce8 s TYR 526 Ca 0.27 -0.97 0.08 0.00 -1.01 0.00 0.00 57.07 55.44 1ce8 s TYR 526 Cb 0.02 -1.53 -0.04 0.00 -0.11 0.00 0.00 41.96 40.29 1ce8 s TYR 526 CO 0.16 -0.44 0.12 0.15 -1.11 0.00 0.00 175.55 174.42 1ce8 s LYS 527 N 0.65 2.53 0.38 -0.62 -0.14 -1.00 0.66 119.74 122.20 1ce8 s LYS 527 Ca -0.13 -1.34 0.08 0.00 -1.36 0.00 0.00 55.97 53.22 1ce8 s LYS 527 Cb -0.16 -2.30 -0.06 0.00 -1.68 0.00 0.00 37.83 33.62 1ce8 s LYS 527 CO 0.03 0.28 0.08 1.03 -0.76 0.00 0.00 175.35 176.02 1ce8 s ARG 528 N -3.80 2.13 -0.03 1.68 0.52 -1.26 -1.98 118.95 116.21 1ce8 s ARG 528 Ca 0.34 -1.83 -0.11 0.00 -0.52 0.00 0.00 55.73 53.61 1ce8 s ARG 528 Cb -0.06 -1.91 -0.05 0.00 0.52 0.00 0.00 34.95 33.45 1ce8 s ARG 528 CO 0.23 0.01 0.30 0.08 0.02 0.00 0.00 175.30 175.94 1ce8 s VAL 529 N -2.58 5.22 0.00 3.52 1.01 -0.48 -4.97 120.40 122.12 1ce8 s VAL 529 Ca 0.37 0.51 0.00 0.00 0.00 0.00 0.00 61.98 62.86 1ce8 s VAL 529 Cb 0.03 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.82 1ce8 s VAL 529 CO 0.21 0.53 0.00 -0.90 0.00 0.00 0.00 175.10 174.94 1ce8 n ASP 530 N 1.67 0.00 0.00 3.32 5.68 -1.26 -4.76 116.55 121.20 1ce8 n ASP 530 Ca -0.15 -0.23 0.00 0.00 -0.50 0.00 0.00 54.79 53.92 1ce8 n ASP 530 Cb 0.53 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 1ce8 n ASP 530 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1ce8 n THR 531 N 0.00 0.00 -0.72 2.12 -2.24 -1.18 -4.64 114.28 107.62 1ce8 n THR 531 Ca 0.00 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.87 1ce8 n THR 531 Cb 0.06 0.00 0.37 0.00 -2.10 0.00 0.00 70.33 68.66 1ce8 n THR 531 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ce8 n ALA 533 N 0.90 -0.95 -0.98 0.00 0.00 0.11 -1.35 120.51 118.24 1ce8 n ALA 533 Ca 0.26 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1ce8 n ALA 533 Cb 0.98 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 18.07 1ce8 n ALA 533 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ce8 n ALA 534 N -3.01 0.00 0.24 0.00 0.00 -1.26 -4.87 120.51 111.61 1ce8 n ALA 534 Ca -0.07 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.44 1ce8 n ALA 534 Cb 0.57 -0.06 0.58 0.00 0.00 0.00 0.00 19.45 20.54 1ce8 n ALA 534 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1ce8 h GLU 535 N 2.04 0.00 -5.27 0.00 4.81 -1.63 -3.43 114.58 111.10 1ce8 h GLU 535 Ca 0.00 0.00 -0.49 0.00 -0.13 0.00 0.00 59.36 58.74 1ce8 h GLU 535 Cb 0.02 0.00 -0.29 0.00 0.63 0.00 0.00 28.75 29.11 1ce8 h GLU 535 CO 0.00 0.11 -0.81 -0.06 -0.73 0.00 0.00 179.01 177.52 1ce8 s PHE 536 N -4.74 1.28 0.63 0.92 0.08 -1.26 -5.15 117.98 109.74 1ce8 s PHE 536 Ca -0.04 -0.25 -0.17 0.00 0.12 0.00 0.00 56.93 56.59 1ce8 s PHE 536 Cb 0.16 -0.83 -0.01 0.00 -0.57 0.00 0.00 43.02 41.77 1ce8 s PHE 536 CO 0.67 -0.03 1.16 0.00 -0.10 0.00 0.00 175.22 176.92 1ce8 s ALA 537 N -0.29 2.46 0.03 5.36 0.00 -1.26 -4.95 121.76 123.10 1ce8 s ALA 537 Ca 0.05 0.78 0.08 0.00 0.00 0.00 0.00 51.96 52.86 1ce8 s ALA 537 Cb -0.06 -3.39 -0.02 0.00 0.00 0.00 0.00 23.12 19.65 1ce8 s ALA 537 CO -0.00 -1.27 -0.22 -0.08 0.00 0.00 0.00 175.76 174.18 1ce8 s THR 538 N -1.98 1.79 -2.08 0.00 -1.32 -1.26 -4.49 115.64 106.31 1ce8 s THR 538 Ca 0.72 -1.17 0.19 0.00 -1.21 0.00 0.00 61.69 60.21 1ce8 s THR 538 Cb -0.25 -1.53 0.08 0.00 -1.51 0.00 0.00 72.50 69.29 1ce8 s THR 538 CO 0.37 0.32 1.03 0.47 -2.21 0.00 0.00 174.62 174.60 1ce8 n ASP 539 N 2.01 2.23 -4.82 8.08 8.00 -1.26 -4.93 116.55 125.86 1ce8 n ASP 539 Ca -0.17 -1.62 -0.37 0.00 0.71 0.00 0.00 54.79 53.34 1ce8 n ASP 539 Cb 0.53 0.21 -0.06 0.00 -0.02 0.00 0.00 41.12 41.77 1ce8 n ASP 539 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ce8 s THR 540 N -1.82 5.20 -1.01 -3.53 2.01 -1.26 -5.04 115.64 110.19 1ce8 s THR 540 Ca 0.19 0.64 -0.02 0.00 0.31 0.00 0.00 61.69 62.81 1ce8 s THR 540 Cb 0.15 -3.62 0.31 0.00 0.01 0.00 0.00 72.50 69.35 1ce8 s THR 540 CO 0.34 0.54 1.62 0.00 -0.69 0.00 0.00 174.62 176.43 1ce8 n ALA 541 N 2.25 5.60 -3.35 7.40 0.00 -1.26 -4.90 120.51 126.25 1ce8 n ALA 541 Ca -0.15 -4.70 -0.45 0.00 0.00 0.00 0.00 53.44 48.14 1ce8 n ALA 541 Cb 0.53 -2.14 -0.05 0.00 0.00 0.00 0.00 19.45 17.79 1ce8 n ALA 541 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1ce8 s TYR 542 N -3.65 3.32 0.25 0.00 6.14 -1.26 -2.15 117.35 119.99 1ce8 s TYR 542 Ca 0.36 -1.45 0.11 0.00 0.64 0.00 0.00 57.07 56.74 1ce8 s TYR 542 Cb 0.14 -3.75 -0.05 0.00 0.42 0.00 0.00 41.96 38.72 1ce8 s TYR 542 CO -0.03 -1.01 -0.15 -1.64 0.64 0.00 0.00 175.55 173.36 1ce8 s MET 543 N 1.45 1.84 0.02 4.97 -1.94 0.27 -1.38 119.30 124.53 1ce8 s MET 543 Ca 0.05 -1.58 0.01 0.00 -1.71 0.00 0.00 55.69 52.45 1ce8 s MET 543 Cb -0.28 -1.92 -0.02 0.00 2.01 0.00 0.00 34.83 34.62 1ce8 s MET 543 CO 0.02 0.36 -0.04 1.52 -0.01 0.00 0.00 175.02 176.87 1ce8 s TYR 544 N -2.22 0.35 0.32 -0.03 1.13 -0.84 -1.28 117.35 114.77 1ce8 s TYR 544 Ca 0.28 -0.36 -0.13 0.00 -1.41 0.00 0.00 57.07 55.45 1ce8 s TYR 544 Cb -0.06 -0.23 -0.08 0.00 -1.10 0.00 0.00 41.96 40.49 1ce8 s TYR 544 CO 0.15 -0.10 0.70 -1.54 -2.51 0.00 0.00 175.55 172.25 1ce8 s SER 545 N -1.04 6.68 0.06 -0.18 1.04 -1.26 -2.37 113.70 116.64 1ce8 s SER 545 Ca -0.09 1.16 -0.27 0.00 0.48 0.00 0.00 55.95 57.23 1ce8 s SER 545 Cb -0.07 -2.33 0.09 0.00 0.10 0.00 0.00 66.02 63.81 1ce8 s SER 545 CO -0.00 -0.22 0.87 0.28 0.98 0.00 0.00 173.24 175.15 1ce8 s THR 546 N -2.03 0.00 -0.97 2.02 -1.32 -1.00 -4.77 115.64 107.57 1ce8 s THR 546 Ca 0.52 -0.20 -0.09 0.00 -1.21 0.00 0.00 61.69 60.72 1ce8 s THR 546 Cb -0.10 -1.28 0.25 0.00 -1.51 0.00 0.00 72.50 69.85 1ce8 s THR 546 CO 0.21 0.00 0.92 -0.31 -2.21 0.00 0.00 174.62 173.23 1ce8 s TYR 547 N -3.26 4.02 0.00 9.09 1.51 -1.26 0.16 117.35 127.61 1ce8 s TYR 547 Ca 0.06 -2.58 0.00 0.00 -1.01 0.00 0.00 57.07 53.54 1ce8 s TYR 547 Cb -0.01 -3.68 0.00 0.00 -0.11 0.00 0.00 41.96 38.15 1ce8 s TYR 547 CO -0.06 -0.91 0.00 -1.91 -1.11 0.00 0.00 175.55 171.55 1ce8 n GLU 548 N 3.00 3.13 -0.04 -0.62 2.13 -1.26 -4.84 120.64 122.14 1ce8 n GLU 548 Ca 0.20 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.98 1ce8 n GLU 548 Cb 0.41 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 32.10 1ce8 n GLU 548 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1ce8 n GLU 549 N 0.00 0.26 -2.60 5.31 -0.58 -1.26 -4.79 120.64 116.97 1ce8 n GLU 549 Ca 0.00 0.20 -0.37 0.00 -0.42 0.00 0.00 57.16 56.57 1ce8 n GLU 549 Cb 0.00 -1.06 -0.05 0.00 -0.57 0.00 0.00 31.44 29.76 1ce8 n GLU 549 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 1ce8 s GLU 550 N -1.88 4.28 -0.16 3.49 2.12 -1.26 -4.99 118.70 120.31 1ce8 s GLU 550 Ca -0.13 1.47 -0.00 0.00 0.36 0.00 0.00 54.97 56.67 1ce8 s GLU 550 Cb 0.02 -2.61 -0.01 0.00 0.26 0.00 0.00 34.13 31.80 1ce8 s GLU 550 CO 0.19 -0.03 -0.13 0.00 -0.54 0.00 0.00 175.26 174.74 1ce8 n GLU 552 N 4.02 2.81 0.31 0.00 1.02 0.21 -4.64 120.64 124.37 1ce8 n GLU 552 Ca -0.19 -2.61 -0.12 0.00 -0.02 0.00 0.00 57.16 54.22 1ce8 n GLU 552 Cb 0.52 -1.60 -0.06 0.00 -0.02 0.00 0.00 31.44 30.27 1ce8 n GLU 552 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ce8 h ALA 553 N 4.29 -1.12 -6.05 0.62 0.00 -1.94 -3.47 119.26 111.60 1ce8 h ALA 553 Ca 0.00 -0.18 -0.39 0.00 0.00 0.00 0.00 54.91 54.34 1ce8 h ALA 553 Cb 1.03 0.31 0.11 0.00 0.00 0.00 0.00 17.79 19.24 1ce8 h ALA 553 CO 0.03 -1.06 -0.92 0.09 0.00 0.00 0.00 179.25 177.39 1ce8 n ASN 554 N -4.35 -5.65 -4.75 0.00 3.02 -1.26 -4.91 115.26 97.36 1ce8 n ASN 554 Ca -0.10 -0.95 -0.38 0.00 -0.03 0.00 0.00 54.58 53.12 1ce8 n ASN 554 Cb 0.32 -3.79 0.05 0.00 -0.61 0.00 0.00 39.78 35.74 1ce8 n ASN 554 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1ce8 s PRO 555 N -5.62 3.08 0.21 3.52 0.04 -1.26 -4.99 135.00 129.97 1ce8 s PRO 555 Ca 0.48 2.26 -0.18 0.00 0.04 0.00 0.00 61.00 63.60 1ce8 s PRO 555 Cb -0.15 -2.23 -0.08 0.00 0.04 0.00 0.00 34.50 32.08 1ce8 s PRO 555 CO 0.83 -1.25 0.68 -1.54 0.04 0.00 0.00 177.00 175.77 1ce8 s SER 556 N -0.94 6.98 0.00 6.66 1.04 -1.26 -4.95 113.70 121.23 1ce8 s SER 556 Ca 0.73 1.32 0.14 0.00 0.48 0.00 0.00 55.95 58.62 1ce8 s SER 556 Cb -0.41 -2.38 -0.13 0.00 0.10 0.00 0.00 66.02 63.19 1ce8 s SER 556 CO 0.48 0.04 0.62 0.35 0.98 0.00 0.00 173.24 175.71 1ce8 n THR 557 N 0.68 0.00 0.00 2.02 -2.24 -1.26 -4.72 114.28 108.76 1ce8 n THR 557 Ca -0.03 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 1ce8 n THR 557 Cb 0.51 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.76 1ce8 n THR 557 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1ce8 n ASP 558 N -1.19 0.00 -4.60 3.42 8.00 -1.26 -4.92 116.55 116.00 1ce8 n ASP 558 Ca 0.03 0.51 -0.27 0.00 0.71 0.00 0.00 54.79 55.77 1ce8 n ASP 558 Cb 0.23 -0.01 0.12 0.00 -0.02 0.00 0.00 41.12 41.44 1ce8 n ASP 558 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1ce8 s ARG 559 N -1.03 1.53 -0.20 -1.24 0.52 -1.26 -5.07 118.95 112.20 1ce8 s ARG 559 Ca 0.00 -0.42 -0.18 0.00 -0.52 0.00 0.00 55.73 54.61 1ce8 s ARG 559 Cb 0.00 -2.06 -0.03 0.00 0.52 0.00 0.00 34.95 33.38 1ce8 s ARG 559 CO 0.00 -1.73 0.50 -1.21 0.02 0.00 0.00 175.30 172.88 1ce8 s GLU 560 N -5.49 4.18 -0.15 3.54 2.02 -1.26 -4.92 118.70 116.62 1ce8 s GLU 560 Ca 0.66 0.38 -0.05 0.00 0.02 0.00 0.00 54.97 55.98 1ce8 s GLU 560 Cb -0.07 -3.56 -0.04 0.00 0.10 0.00 0.00 34.13 30.56 1ce8 s GLU 560 CO 0.48 -0.15 0.03 0.15 0.02 0.00 0.00 175.26 175.79 1ce8 s LYS 561 N 1.64 3.64 -0.16 1.61 1.02 -1.26 0.98 119.74 127.21 1ce8 s LYS 561 Ca 0.23 -0.38 0.01 0.00 0.02 0.00 0.00 55.97 55.84 1ce8 s LYS 561 Cb -0.15 -3.04 0.02 0.00 -0.52 0.00 0.00 37.83 34.13 1ce8 s LYS 561 CO 0.09 0.40 -0.16 0.42 -0.92 0.00 0.00 175.35 175.18 1ce8 s ILE 562 N -0.03 1.76 -0.25 2.17 -1.09 0.73 0.18 121.20 124.68 1ce8 s ILE 562 Ca 0.05 -0.75 -0.14 0.00 -2.23 0.00 0.00 60.65 57.58 1ce8 s ILE 562 Cb -0.12 -1.62 -0.04 0.00 -1.58 0.00 0.00 42.46 39.09 1ce8 s ILE 562 CO 0.01 0.49 0.32 -0.32 -1.23 0.00 0.00 174.94 174.22 1ce8 s MET 563 N 1.40 4.06 -0.15 2.79 -2.45 0.71 -1.07 119.30 124.58 1ce8 s MET 563 Ca 0.05 -0.01 -0.05 0.00 -1.25 0.00 0.00 55.69 54.43 1ce8 s MET 563 Cb -0.13 -3.61 -0.03 0.00 1.25 0.00 0.00 34.83 32.31 1ce8 s MET 563 CO -0.11 -0.15 -0.00 0.08 1.05 0.00 0.00 175.02 175.89 1ce8 s VAL 564 N 1.68 4.24 -0.32 10.11 1.01 -0.54 -0.21 120.40 136.37 1ce8 s VAL 564 Ca 0.14 -0.24 -0.08 0.00 0.00 0.00 0.00 61.98 61.80 1ce8 s VAL 564 Cb -0.15 -2.86 0.02 0.00 0.00 0.00 0.00 36.38 33.39 1ce8 s VAL 564 CO 0.09 0.50 0.11 -0.76 0.00 0.00 0.00 175.10 175.04 1ce8 s LEU 565 N 0.15 4.16 0.00 3.92 1.43 -1.07 -1.29 118.68 125.99 1ce8 s LEU 565 Ca 0.01 -0.89 -0.03 0.00 -1.03 0.00 0.00 54.13 52.19 1ce8 s LEU 565 Cb -0.13 -1.91 0.05 0.00 0.03 0.00 0.00 46.19 44.23 1ce8 s LEU 565 CO 0.02 -0.27 0.21 0.61 0.23 0.00 0.00 176.35 177.15 1ce8 n GLY 566 N 4.88 -2.01 0.62 -3.19 0.00 -0.20 -3.62 105.19 101.67 1ce8 n GLY 566 Ca -0.13 -1.54 0.07 0.00 0.00 0.00 0.00 46.02 44.42 1ce8 n GLY 566 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ce8 n GLY 567 N 2.04 4.51 7.00 -0.02 0.00 -1.24 -4.19 105.19 113.29 1ce8 n GLY 567 Ca 0.03 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.93 1ce8 n GLY 567 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ce8 n GLY 568 N -0.95 0.20 3.77 -0.02 0.00 -1.26 -4.70 105.19 102.22 1ce8 n GLY 568 Ca 0.21 -0.94 -0.39 0.00 0.00 0.00 0.00 46.02 44.90 1ce8 n GLY 568 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ce8 s PRO 569 N 0.00 4.01 0.53 1.61 0.04 -1.26 -4.32 135.00 135.61 1ce8 s PRO 569 Ca 0.00 1.98 -0.19 0.00 0.04 0.00 0.00 61.00 62.83 1ce8 s PRO 569 Cb 0.00 -2.71 -0.06 0.00 0.04 0.00 0.00 34.50 31.77 1ce8 s PRO 569 CO 0.00 -0.40 1.11 -0.80 0.04 0.00 0.00 177.00 176.95 1ce8 s ASN 570 N -0.96 5.85 0.22 6.66 0.02 -1.26 -4.88 114.94 120.59 1ce8 s ASN 570 Ca 0.57 2.11 -0.11 0.00 -1.02 0.00 0.00 52.86 54.40 1ce8 s ASN 570 Cb -0.34 -2.57 -0.01 0.00 0.02 0.00 0.00 41.25 38.35 1ce8 s ASN 570 CO 0.43 -1.13 0.41 -0.13 0.02 0.00 0.00 177.10 176.70 1ce8 s ARG 571 N -3.31 1.41 0.10 -0.60 3.00 -1.06 -3.38 118.95 115.10 1ce8 s ARG 571 Ca 0.71 -1.23 -0.31 0.00 0.00 0.00 0.00 55.73 54.90 1ce8 s ARG 571 Cb -0.22 0.44 -0.09 0.00 0.00 0.00 0.00 34.95 35.08 1ce8 s ARG 571 CO 0.26 -0.57 1.69 0.42 0.00 0.00 0.00 175.30 177.10 1ce8 s ILE 572 N -4.01 2.85 0.00 1.52 1.01 -1.26 -0.69 121.20 120.62 1ce8 s ILE 572 Ca 0.21 0.37 0.00 0.00 0.00 0.00 0.00 60.65 61.23 1ce8 s ILE 572 Cb 0.01 -3.24 0.00 0.00 0.01 0.00 0.00 42.46 39.24 1ce8 s ILE 572 CO 0.06 0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.61 1ce8 n GLY 573 N 4.02 1.62 2.24 6.18 0.00 -1.26 -4.91 105.19 113.08 1ce8 n GLY 573 Ca 0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.97 1ce8 n GLY 573 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ce8 n GLN 574 N -2.00 1.07 -0.01 1.61 1.13 0.13 -4.98 117.38 114.33 1ce8 n GLN 574 Ca 0.00 -3.46 0.00 0.00 -1.94 0.00 0.00 57.00 51.60 1ce8 n GLN 574 Cb 0.00 -1.56 0.00 0.00 0.11 0.00 0.00 30.24 28.79 1ce8 n GLN 574 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ce8 n GLY 575 N 0.74 0.70 0.35 1.08 0.00 -1.23 -2.58 105.19 104.25 1ce8 n GLY 575 Ca 0.24 -1.85 0.18 0.00 0.00 0.00 0.00 46.02 44.58 1ce8 n GLY 575 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1ce8 h ILE 576 N -0.01 0.37 -0.87 -0.61 2.10 -1.91 -2.64 117.51 113.93 1ce8 h ILE 576 Ca 0.00 0.00 0.20 0.00 1.08 0.00 0.00 64.86 66.14 1ce8 h ILE 576 Cb 0.00 0.79 -0.12 0.00 -1.09 0.00 0.00 36.82 36.40 1ce8 h ILE 576 CO 0.00 0.00 0.39 -0.33 -1.08 0.00 0.00 178.15 177.13 1ce8 h GLU 577 N 0.00 0.43 0.08 2.19 3.07 -1.91 0.41 114.58 118.85 1ce8 h GLU 577 Ca 0.09 -0.03 -0.27 0.00 -0.50 0.00 0.00 59.36 58.66 1ce8 h GLU 577 Cb 0.60 -0.10 0.01 0.00 -0.84 0.00 0.00 28.75 28.43 1ce8 h GLU 577 CO -0.00 0.28 -1.13 0.74 -1.40 0.00 0.00 179.01 177.50 1ce8 h PHE 578 N 0.44 0.77 -0.59 4.33 0.04 -1.71 -3.00 116.94 117.23 1ce8 h PHE 578 Ca 0.53 -0.47 0.01 0.00 2.80 0.00 0.00 57.97 60.83 1ce8 h PHE 578 Cb 0.94 -0.07 -0.03 0.00 2.20 0.00 0.00 35.95 38.99 1ce8 h PHE 578 CO -0.14 1.32 0.38 0.22 -0.60 0.00 0.00 178.31 179.50 1ce8 h ASP 579 N 0.23 0.65 -0.79 2.17 3.58 -1.10 -0.22 116.42 120.95 1ce8 h ASP 579 Ca -0.14 -0.01 0.17 0.00 0.42 0.00 0.00 57.03 57.47 1ce8 h ASP 579 Cb 1.80 -0.16 -0.11 0.00 1.72 0.00 0.00 39.33 42.59 1ce8 h ASP 579 CO 0.20 0.47 0.28 0.22 -2.88 0.00 0.00 179.24 177.53 1ce8 h TYR 580 N 0.78 0.46 -0.29 0.28 5.03 -0.27 0.22 116.97 123.17 1ce8 h TYR 580 Ca 0.22 0.04 -0.03 0.00 2.58 0.00 0.00 58.73 61.54 1ce8 h TYR 580 Cb -0.06 -0.08 -0.01 0.00 1.55 0.00 0.00 36.73 38.13 1ce8 h TYR 580 CO -0.04 -0.03 0.07 0.00 -1.32 0.00 0.00 178.16 176.85 1ce8 h VAL 583 N 0.53 0.26 -1.02 0.00 2.07 -0.61 -2.20 116.25 115.28 1ce8 h VAL 583 Ca 0.16 0.00 0.25 0.00 0.82 0.00 0.00 66.70 67.93 1ce8 h VAL 583 Cb -0.02 0.26 -0.12 0.00 -1.52 0.00 0.00 31.29 29.89 1ce8 h VAL 583 CO -0.06 0.00 0.62 0.45 0.02 0.00 0.00 177.57 178.60 1ce8 h HIS 584 N -0.79 0.93 -0.50 1.57 -0.00 -1.09 0.71 115.15 115.98 1ce8 h HIS 584 Ca -0.04 0.03 -0.07 0.00 -0.00 0.00 0.00 60.37 60.30 1ce8 h HIS 584 Cb 0.69 -0.27 -0.02 0.00 -0.00 0.00 0.00 27.41 27.81 1ce8 h HIS 584 CO -0.18 0.07 0.04 0.00 -0.00 0.00 0.00 177.93 177.86 1ce8 h ALA 585 N 1.70 1.14 0.17 2.45 0.00 -0.55 -0.41 119.26 123.76 1ce8 h ALA 585 Ca 0.63 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.29 1ce8 h ALA 585 Cb 1.30 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1ce8 h ALA 585 CO -0.43 0.56 -0.08 1.03 0.00 0.00 0.00 179.25 180.33 1ce8 h SER 586 N 0.75 -0.19 -0.79 0.00 0.87 0.69 -2.68 113.55 112.21 1ce8 h SER 586 Ca 0.15 -0.33 0.18 0.00 -1.23 0.00 0.00 61.79 60.57 1ce8 h SER 586 Cb 0.40 0.05 -0.14 0.00 -0.44 0.00 0.00 62.40 62.27 1ce8 h SER 586 CO 0.01 0.36 0.04 -0.07 -0.53 0.00 0.00 176.83 176.65 1ce8 h LEU 587 N -0.89 -0.31 0.82 2.23 3.38 -0.46 0.68 115.31 120.77 1ce8 h LEU 587 Ca -0.02 0.20 -0.04 0.00 0.09 0.00 0.00 57.88 58.11 1ce8 h LEU 587 Cb 0.51 0.34 0.01 0.00 0.09 0.00 0.00 40.66 41.61 1ce8 h LEU 587 CO 0.04 -0.18 -0.39 0.00 0.09 0.00 0.00 178.44 177.99 1ce8 h ALA 588 N 1.73 -1.26 -0.34 1.53 0.00 -1.13 -2.35 119.26 117.44 1ce8 h ALA 588 Ca 0.44 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 1ce8 h ALA 588 Cb 0.80 0.42 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1ce8 h ALA 588 CO -0.68 -1.18 -0.27 -0.07 0.00 0.00 0.00 179.25 177.05 1ce8 h LEU 589 N -1.12 0.71 -0.28 0.00 3.38 -1.26 -2.62 115.31 114.12 1ce8 h LEU 589 Ca -0.11 -0.27 0.02 0.00 0.09 0.00 0.00 57.88 57.62 1ce8 h LEU 589 Cb 0.84 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 1ce8 h LEU 589 CO 0.18 0.94 0.12 -0.09 0.09 0.00 0.00 178.44 179.68 1ce8 h ARG 590 N 0.60 0.25 0.00 1.13 2.43 -0.94 -0.42 114.38 117.43 1ce8 h ARG 590 Ca 0.08 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1ce8 h ARG 590 Cb 0.76 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.26 1ce8 h ARG 590 CO 0.06 0.16 0.00 -1.91 -1.51 0.00 0.00 179.97 176.77 1ce8 n GLU 591 N -5.00 0.03 -1.42 0.20 4.07 -0.89 -0.94 120.64 116.68 1ce8 n GLU 591 Ca -0.01 0.46 -0.23 0.00 -0.06 0.00 0.00 57.16 57.33 1ce8 n GLU 591 Cb 0.08 -1.58 0.10 0.00 -0.06 0.00 0.00 31.44 29.98 1ce8 n GLU 591 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1ce8 n ASP 592 N -1.63 5.10 -0.22 4.31 9.92 -0.27 -4.96 116.55 128.81 1ce8 n ASP 592 Ca 0.01 -3.77 -0.03 0.00 -0.53 0.00 0.00 54.79 50.47 1ce8 n ASP 592 Cb 0.05 -0.66 -0.01 0.00 -0.64 0.00 0.00 41.12 39.86 1ce8 n ASP 592 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ce8 n GLY 593 N -0.92 0.24 3.91 0.44 0.00 -0.12 -4.96 105.19 103.78 1ce8 n GLY 593 Ca 0.49 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.24 1ce8 n GLY 593 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ce8 s TYR 594 N -1.06 3.47 -0.45 1.61 2.02 -0.59 -4.76 117.35 117.59 1ce8 s TYR 594 Ca 0.00 0.70 -0.21 0.00 -0.37 0.00 0.00 57.07 57.19 1ce8 s TYR 594 Cb 0.00 -2.36 0.03 0.00 -0.40 0.00 0.00 41.96 39.23 1ce8 s TYR 594 CO 0.00 -0.36 0.67 -2.00 -1.57 0.00 0.00 175.55 172.28 1ce8 s GLU 595 N -4.75 3.28 -0.11 -0.62 2.12 0.27 -4.27 118.70 114.63 1ce8 s GLU 595 Ca 0.48 -0.39 -0.14 0.00 0.36 0.00 0.00 54.97 55.29 1ce8 s GLU 595 Cb -0.10 -3.97 -0.05 0.00 0.26 0.00 0.00 34.13 30.27 1ce8 s GLU 595 CO 0.44 -1.06 0.33 0.95 -0.54 0.00 0.00 175.26 175.38 1ce8 s THR 596 N 2.89 5.24 -0.23 -1.70 -4.23 -1.26 -0.19 115.64 116.16 1ce8 s THR 596 Ca 0.23 0.64 0.01 0.00 -1.18 0.00 0.00 61.69 61.39 1ce8 s THR 596 Cb -0.14 -3.65 0.06 0.00 1.34 0.00 0.00 72.50 70.10 1ce8 s THR 596 CO 0.19 0.46 -0.08 -0.63 -0.54 0.00 0.00 174.62 174.02 1ce8 s ILE 597 N -0.10 1.69 0.06 2.99 1.01 -0.23 -0.83 121.20 125.79 1ce8 s ILE 597 Ca 0.19 -1.24 -0.19 0.00 0.00 0.00 0.00 60.65 59.41 1ce8 s ILE 597 Cb -0.14 -1.87 -0.06 0.00 0.01 0.00 0.00 42.46 40.39 1ce8 s ILE 597 CO 0.07 -0.01 0.55 -0.32 0.00 0.00 0.00 174.94 175.23 1ce8 s MET 598 N 1.34 4.17 -0.32 2.79 1.75 0.30 -1.47 119.30 127.86 1ce8 s MET 598 Ca -0.05 0.70 0.01 0.00 -1.25 0.00 0.00 55.69 55.09 1ce8 s MET 598 Cb -0.18 -3.24 0.10 0.00 2.84 0.00 0.00 34.83 34.34 1ce8 s MET 598 CO -0.06 0.63 0.08 0.08 -0.65 0.00 0.00 175.02 175.09 1ce8 s VAL 599 N -1.05 1.39 0.23 10.11 1.01 -0.41 -0.71 120.40 130.97 1ce8 s VAL 599 Ca 0.28 -1.73 -0.20 0.00 0.00 0.00 0.00 61.98 60.34 1ce8 s VAL 599 Cb -0.19 -2.03 0.03 0.00 0.00 0.00 0.00 36.38 34.19 1ce8 s VAL 599 CO 0.18 -0.64 0.62 0.21 0.00 0.00 0.00 175.10 175.48 1ce8 s ASN 600 N 1.36 -0.31 -0.03 3.32 2.47 -0.96 -1.04 114.94 119.75 1ce8 s ASN 600 Ca 0.10 -0.48 0.05 0.00 0.42 0.00 0.00 52.86 52.95 1ce8 s ASN 600 Cb -0.18 0.65 0.07 0.00 -1.45 0.00 0.00 41.25 40.34 1ce8 s ASN 600 CO -0.19 -1.17 1.04 0.00 -3.72 0.00 0.00 177.10 173.06 1ce8 s ASN 602 N -1.42 6.22 0.46 0.00 2.47 -1.26 -0.70 114.94 120.71 1ce8 s ASN 602 Ca 0.08 -0.34 0.23 0.00 0.42 0.00 0.00 52.86 53.24 1ce8 s ASN 602 Cb 0.07 -2.23 1.09 0.00 -1.45 0.00 0.00 41.25 38.73 1ce8 s ASN 602 CO 0.00 -0.47 1.92 1.55 -3.72 0.00 0.00 177.10 176.38 1ce8 h PRO 603 N 8.57 0.00 0.00 0.43 0.13 -1.92 -3.26 132.00 135.96 1ce8 h PRO 603 Ca -0.28 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.83 1ce8 h PRO 603 Cb 1.13 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.25 1ce8 h PRO 603 CO 0.76 0.22 -0.08 0.93 -0.23 0.00 0.00 178.00 179.60 1ce8 h GLU 604 N 0.00 0.00 -6.27 0.86 5.08 -1.90 -3.44 114.58 108.92 1ce8 h GLU 604 Ca -0.00 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 57.90 1ce8 h GLU 604 Cb 0.58 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 1ce8 h GLU 604 CO 0.03 0.08 -0.38 0.95 -1.00 0.00 0.00 179.01 178.68 1ce8 s THR 605 N -3.94 4.26 0.35 1.13 -4.23 -1.23 -2.27 115.64 109.72 1ce8 s THR 605 Ca -0.01 -1.07 0.10 0.00 -1.18 0.00 0.00 61.69 59.53 1ce8 s THR 605 Cb 0.11 -3.47 0.08 0.00 1.34 0.00 0.00 72.50 70.56 1ce8 s THR 605 CO 0.55 -0.21 1.79 0.58 -0.54 0.00 0.00 174.62 176.80 1ce8 h VAL 606 N 1.03 1.28 0.00 2.29 2.07 -1.91 -2.73 116.25 118.28 1ce8 h VAL 606 Ca -0.47 -1.32 -0.03 0.00 0.82 0.00 0.00 66.70 65.70 1ce8 h VAL 606 Cb 1.25 1.65 -0.00 0.00 -1.52 0.00 0.00 31.29 32.66 1ce8 h VAL 606 CO 0.56 0.38 -0.12 0.77 0.02 0.00 0.00 177.57 179.18 1ce8 h SER 607 N 0.08 0.00 -0.58 0.57 4.64 -1.92 -1.28 113.55 115.06 1ce8 h SER 607 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1ce8 h SER 607 Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 1ce8 h SER 607 CO 0.05 0.12 0.00 0.35 -0.87 0.00 0.00 176.83 176.48 1ce8 n THR 608 N -3.52 1.96 -3.00 2.95 -2.24 -1.03 -4.88 114.28 104.52 1ce8 n THR 608 Ca -0.01 -1.29 -0.40 0.00 -2.27 0.00 0.00 64.05 60.08 1ce8 n THR 608 Cb 0.27 0.06 -0.05 0.00 -2.10 0.00 0.00 70.33 68.51 1ce8 n THR 608 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ce8 s ASP 609 N -1.01 6.98 0.29 3.42 -1.08 -0.48 -4.96 116.67 119.83 1ce8 s ASP 609 Ca 0.49 1.18 0.03 0.00 -0.52 0.00 0.00 52.55 53.73 1ce8 s ASP 609 Cb 0.33 -2.42 0.69 0.00 -1.46 0.00 0.00 42.92 40.05 1ce8 s ASP 609 CO 0.21 -0.20 1.73 0.10 0.52 0.00 0.00 175.17 177.53 1ce8 h TYR 610 N 6.95 0.79 0.00 -5.34 -0.00 -1.90 -2.58 116.97 114.90 1ce8 h TYR 610 Ca -0.38 0.04 -0.01 0.00 0.00 0.00 0.00 58.73 58.38 1ce8 h TYR 610 Cb 1.18 -0.21 -0.00 0.00 0.00 0.00 0.00 36.73 37.70 1ce8 h TYR 610 CO 0.67 0.07 -0.03 -0.44 -0.00 0.00 0.00 178.16 178.43 1ce8 h ASP 611 N 0.54 0.00 0.28 0.10 3.32 -1.92 -3.24 116.42 115.49 1ce8 h ASP 611 Ca 0.54 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.57 1ce8 h ASP 611 Cb 0.94 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.49 1ce8 h ASP 611 CO -0.45 0.03 -0.11 0.74 -1.72 0.00 0.00 179.24 177.74 1ce8 h THR 612 N 0.00 0.63 -4.29 0.35 2.02 -1.68 -3.46 112.91 106.48 1ce8 h THR 612 Ca -0.00 -0.45 -0.18 0.00 0.77 0.00 0.00 66.41 66.55 1ce8 h THR 612 Cb 0.07 1.28 -0.14 0.00 -1.74 0.00 0.00 68.15 67.62 1ce8 h THR 612 CO 0.00 0.10 -0.49 -0.94 0.37 0.00 0.00 175.52 174.57 1ce8 s SER 613 N -6.26 0.12 0.02 4.18 1.04 -1.22 -4.17 113.70 107.40 1ce8 s SER 613 Ca -0.03 -1.20 -0.23 0.00 0.48 0.00 0.00 55.95 54.97 1ce8 s SER 613 Cb 0.14 0.41 -0.17 0.00 0.10 0.00 0.00 66.02 66.50 1ce8 s SER 613 CO 0.59 -0.88 1.36 0.44 0.98 0.00 0.00 173.24 175.73 1ce8 h ASP 614 N 2.59 0.17 -3.77 7.02 3.32 -1.30 -3.45 116.42 120.99 1ce8 h ASP 614 Ca -0.33 -0.42 -0.42 0.00 0.02 0.00 0.00 57.03 55.87 1ce8 h ASP 614 Cb 1.24 -0.05 -0.31 0.00 0.22 0.00 0.00 39.33 40.43 1ce8 h ASP 614 CO 0.50 0.55 -0.78 -0.13 -1.72 0.00 0.00 179.24 177.66 1ce8 s ARG 615 N -4.53 0.93 -0.09 3.56 0.52 -0.01 -4.50 118.95 114.83 1ce8 s ARG 615 Ca -0.15 -0.28 0.02 0.00 -0.52 0.00 0.00 55.73 54.80 1ce8 s ARG 615 Cb 0.04 -0.87 0.01 0.00 0.52 0.00 0.00 34.95 34.65 1ce8 s ARG 615 CO 0.71 0.09 -0.13 -1.17 0.02 0.00 0.00 175.30 174.81 1ce8 s LEU 616 N 0.26 1.62 -0.37 2.53 2.96 -0.92 0.11 118.68 124.88 1ce8 s LEU 616 Ca -0.04 -0.36 -0.05 0.00 -0.22 0.00 0.00 54.13 53.46 1ce8 s LEU 616 Cb -0.09 -0.95 0.07 0.00 0.50 0.00 0.00 46.19 45.72 1ce8 s LEU 616 CO 0.00 0.01 0.15 -0.31 -1.32 0.00 0.00 176.35 174.88 1ce8 s TYR 617 N 0.93 3.37 -1.46 5.38 2.02 0.11 -0.57 117.35 127.13 1ce8 s TYR 617 Ca -0.09 -1.81 -0.14 0.00 -0.37 0.00 0.00 57.07 54.67 1ce8 s TYR 617 Cb -0.15 -2.68 0.04 0.00 -0.40 0.00 0.00 41.96 38.77 1ce8 s TYR 617 CO 0.00 -0.84 2.23 0.34 -1.57 0.00 0.00 175.55 175.71 1ce8 n PHE 618 N 4.74 3.51 -4.50 2.71 -0.00 -0.41 -2.27 117.46 121.24 1ce8 n PHE 618 Ca -0.09 -2.98 -0.24 0.00 -0.00 0.00 0.00 57.45 54.14 1ce8 n PHE 618 Cb 0.43 -2.54 -0.10 0.00 -0.00 0.00 0.00 39.48 37.26 1ce8 n PHE 618 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.76 175.55 1ce8 s GLU 619 N 3.11 1.72 0.12 -4.13 0.41 -0.96 -4.67 118.70 114.30 1ce8 s GLU 619 Ca 0.47 -1.88 -0.31 0.00 -0.41 0.00 0.00 54.97 52.84 1ce8 s GLU 619 Cb 0.14 -1.48 -0.08 0.00 -1.78 0.00 0.00 34.13 30.93 1ce8 s GLU 619 CO -0.09 0.09 1.36 -2.14 -0.49 0.00 0.00 175.26 174.00 1ce8 s PRO 620 N -3.66 4.34 -0.88 0.39 0.02 -1.26 -3.24 135.00 130.71 1ce8 s PRO 620 Ca 0.31 2.04 -0.21 0.00 0.02 0.00 0.00 61.00 63.17 1ce8 s PRO 620 Cb 0.03 -3.25 -0.13 0.00 0.02 0.00 0.00 34.50 31.18 1ce8 s PRO 620 CO 0.15 -0.40 1.98 0.28 -0.33 0.00 0.00 177.00 178.68 1ce8 n VAL 621 N 3.78 2.09 -4.57 3.83 0.31 -1.26 -4.52 118.33 117.99 1ce8 n VAL 621 Ca 0.11 -1.82 -0.26 0.00 -0.01 0.00 0.00 64.34 62.36 1ce8 n VAL 621 Cb 0.43 -2.37 -0.11 0.00 -0.91 0.00 0.00 33.84 30.88 1ce8 n VAL 621 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1ce8 s THR 622 N 4.69 1.95 0.10 2.52 -4.23 -1.26 -4.89 115.64 114.52 1ce8 s THR 622 Ca 0.56 -2.06 -0.24 0.00 -1.18 0.00 0.00 61.69 58.77 1ce8 s THR 622 Cb 0.14 -2.85 -0.10 0.00 1.34 0.00 0.00 72.50 71.03 1ce8 s THR 622 CO 0.08 -0.07 1.70 0.25 -0.54 0.00 0.00 174.62 176.04 1ce8 h LEU 623 N 1.91 -0.24 0.69 4.79 5.85 -1.96 0.20 115.31 126.55 1ce8 h LEU 623 Ca -0.43 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.30 1ce8 h LEU 623 Cb 1.24 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.36 1ce8 h LEU 623 CO 0.76 -0.13 -0.50 -0.08 -0.34 0.00 0.00 178.44 178.15 1ce8 h GLU 624 N -0.16 -1.10 -0.52 1.25 4.81 -1.95 0.15 114.58 117.06 1ce8 h GLU 624 Ca 0.03 0.07 0.07 0.00 -0.13 0.00 0.00 59.36 59.40 1ce8 h GLU 624 Cb 0.19 0.25 -0.06 0.00 0.63 0.00 0.00 28.75 29.76 1ce8 h GLU 624 CO -0.07 -0.73 0.19 -0.44 -0.73 0.00 0.00 179.01 177.23 1ce8 h ASP 625 N -1.14 0.21 0.72 1.04 3.32 -1.79 -1.85 116.42 116.93 1ce8 h ASP 625 Ca -0.09 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 56.98 1ce8 h ASP 625 Cb 0.94 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.53 1ce8 h ASP 625 CO 0.04 0.15 -0.37 0.58 -1.72 0.00 0.00 179.24 177.92 1ce8 h VAL 626 N 0.38 0.25 -1.03 -1.35 2.07 -0.46 -2.67 116.25 113.44 1ce8 h VAL 626 Ca 0.25 0.00 0.26 0.00 0.82 0.00 0.00 66.70 68.02 1ce8 h VAL 626 Cb 0.26 0.25 -0.09 0.00 -1.52 0.00 0.00 31.29 30.18 1ce8 h VAL 626 CO -0.24 0.00 0.66 -0.07 0.02 0.00 0.00 177.57 177.94 1ce8 h LEU 627 N -1.00 0.46 -0.86 2.57 3.38 -0.52 0.40 115.31 119.73 1ce8 h LEU 627 Ca -0.10 0.08 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1ce8 h LEU 627 Cb 0.78 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.49 1ce8 h LEU 627 CO 0.14 0.10 0.57 -0.33 0.09 0.00 0.00 178.44 179.02 1ce8 h GLU 628 N 0.41 1.13 -0.30 1.13 4.39 -1.00 -0.72 114.58 119.63 1ce8 h GLU 628 Ca 0.58 -0.07 -0.14 0.00 0.34 0.00 0.00 59.36 60.07 1ce8 h GLU 628 Cb 1.45 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 29.84 1ce8 h GLU 628 CO -0.29 0.75 -0.37 0.82 -1.16 0.00 0.00 179.01 178.76 1ce8 h ILE 629 N 1.16 1.29 -0.22 3.13 2.04 -0.10 -3.14 117.51 121.68 1ce8 h ILE 629 Ca 0.32 -1.55 -0.01 0.00 1.00 0.00 0.00 64.86 64.61 1ce8 h ILE 629 Cb -0.13 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 1ce8 h ILE 629 CO -0.07 0.50 0.09 0.58 0.00 0.00 0.00 178.15 179.25 1ce8 h VAL 630 N 0.54 1.09 -0.42 1.67 2.07 -0.45 0.68 116.25 121.43 1ce8 h VAL 630 Ca 0.04 -0.27 -0.05 0.00 0.82 0.00 0.00 66.70 67.24 1ce8 h VAL 630 Cb 0.96 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 1ce8 h VAL 630 CO 0.09 0.10 0.06 -0.09 0.02 0.00 0.00 177.57 177.75 1ce8 h ARG 631 N 0.31 0.64 0.02 1.57 2.43 -1.10 -0.88 114.38 117.38 1ce8 h ARG 631 Ca 0.08 -0.13 -0.38 0.00 -0.81 0.00 0.00 59.98 58.74 1ce8 h ARG 631 Cb 0.06 -0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 29.46 1ce8 h ARG 631 CO -0.01 0.62 -2.35 0.44 -1.51 0.00 0.00 179.97 177.16 1ce8 n ILE 632 N -4.29 1.54 -0.12 1.20 -5.35 -0.79 -4.44 119.36 107.11 1ce8 n ILE 632 Ca 0.02 -0.63 -0.12 0.00 -0.27 0.00 0.00 62.75 61.75 1ce8 n ILE 632 Cb 0.23 -1.36 -0.01 0.00 -1.74 0.00 0.00 39.64 36.77 1ce8 n ILE 632 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 1ce8 h GLU 633 N 0.01 0.94 -6.46 6.28 4.39 -0.96 -3.46 114.58 115.32 1ce8 h GLU 633 Ca -0.54 -0.46 -0.49 0.00 0.34 0.00 0.00 59.36 58.21 1ce8 h GLU 633 Cb 1.97 0.00 0.04 0.00 -0.10 0.00 0.00 28.75 30.66 1ce8 h GLU 633 CO -0.04 1.12 -0.95 1.63 -1.16 0.00 0.00 179.01 179.61 1ce8 n LYS 634 N -4.07 -1.19 -0.90 2.33 5.02 -0.33 -4.91 118.16 114.11 1ce8 n LYS 634 Ca -0.01 0.34 -0.31 0.00 -2.02 0.00 0.00 58.31 56.31 1ce8 n LYS 634 Cb 0.52 -3.74 0.15 0.00 -0.02 0.00 0.00 35.03 31.94 1ce8 n LYS 634 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1ce8 s PRO 635 N -6.45 1.22 -0.03 1.97 0.04 -1.26 -4.95 135.00 125.54 1ce8 s PRO 635 Ca 0.42 1.30 -0.23 0.00 0.04 0.00 0.00 61.00 62.53 1ce8 s PRO 635 Cb -0.18 -1.77 -0.22 0.00 0.04 0.00 0.00 34.50 32.38 1ce8 s PRO 635 CO 0.90 -2.41 1.10 -0.22 0.04 0.00 0.00 177.00 176.41 1ce8 h LYS 636 N -1.70 0.24 -3.48 4.56 3.64 0.16 -3.47 116.57 116.52 1ce8 h LYS 636 Ca -0.46 -0.22 -0.05 0.00 -1.27 0.00 0.00 60.65 58.66 1ce8 h LYS 636 Cb 1.27 0.05 -0.11 0.00 -0.41 0.00 0.00 32.23 33.03 1ce8 h LYS 636 CO 0.47 0.90 -0.08 0.20 -2.27 0.00 0.00 179.45 178.66 1ce8 s GLY 637 N -3.83 0.04 -0.11 5.01 0.00 -0.96 -4.82 107.32 102.65 1ce8 s GLY 637 Ca -0.15 -0.38 -0.01 0.00 0.00 0.00 0.00 44.72 44.18 1ce8 s GLY 637 CO 0.75 -0.43 -0.02 0.14 0.00 0.00 0.00 173.10 173.54 1ce8 s VAL 638 N -3.89 0.66 -0.24 1.40 1.01 -0.49 -0.21 120.40 118.64 1ce8 s VAL 638 Ca 0.10 -0.16 -0.19 0.00 0.00 0.00 0.00 61.98 61.74 1ce8 s VAL 638 Cb 0.01 -0.82 -0.03 0.00 0.00 0.00 0.00 36.38 35.54 1ce8 s VAL 638 CO -0.03 0.22 0.55 -0.63 0.00 0.00 0.00 175.10 175.20 1ce8 s ILE 639 N 1.85 5.06 -0.10 2.22 1.01 0.71 -2.02 121.20 129.92 1ce8 s ILE 639 Ca 0.04 0.97 0.15 0.00 0.00 0.00 0.00 60.65 61.80 1ce8 s ILE 639 Cb -0.13 -3.86 0.22 0.00 0.01 0.00 0.00 42.46 38.70 1ce8 s ILE 639 CO -0.07 0.10 1.11 1.33 0.00 0.00 0.00 174.94 177.41 1ce8 n VAL 640 N 5.00 1.48 0.65 2.92 0.24 -1.26 -2.60 118.33 124.76 1ce8 n VAL 640 Ca -0.03 -1.77 0.08 0.00 -2.04 0.00 0.00 64.34 60.57 1ce8 n VAL 640 Cb 0.50 -0.06 0.04 0.00 -1.47 0.00 0.00 33.84 32.84 1ce8 n VAL 640 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ce8 n GLN 641 N -1.12 1.41 -0.07 7.34 3.00 -1.26 -3.55 117.38 123.13 1ce8 n GLN 641 Ca 0.12 -1.17 -0.08 0.00 -0.01 0.00 0.00 57.00 55.86 1ce8 n GLN 641 Cb 0.64 -1.27 -0.15 0.00 0.00 0.00 0.00 30.24 29.45 1ce8 n GLN 641 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1ce8 n TYR 642 N 0.48 0.31 1.79 1.08 4.02 -1.26 -2.43 117.16 121.15 1ce8 n TYR 642 Ca 0.08 0.11 0.04 0.00 -0.01 0.00 0.00 57.90 58.12 1ce8 n TYR 642 Cb 0.36 -1.02 0.25 0.00 -0.02 0.00 0.00 39.34 38.91 1ce8 n TYR 642 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ce8 n GLY 643 N 1.65 -0.90 4.07 2.72 0.00 -1.24 -4.56 105.19 106.94 1ce8 n GLY 643 Ca -0.26 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1ce8 n GLY 643 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ce8 n GLY 644 N 0.51 -1.72 0.25 -0.02 0.00 -1.26 -3.67 105.19 99.28 1ce8 n GLY 644 Ca 0.06 -1.62 0.06 0.00 0.00 0.00 0.00 46.02 44.53 1ce8 n GLY 644 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1ce8 h GLN 645 N 0.00 0.04 0.95 1.61 1.08 -1.94 -2.84 115.11 114.01 1ce8 h GLN 645 Ca 0.00 -0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.15 1ce8 h GLN 645 Cb 0.00 -0.01 0.01 0.00 -0.05 0.00 0.00 27.48 27.43 1ce8 h GLN 645 CO 0.00 0.11 -0.45 1.15 -0.95 0.00 0.00 178.83 178.68 1ce8 h THR 646 N 0.04 0.00 0.00 -0.54 2.02 -1.84 -2.33 112.91 110.26 1ce8 h THR 646 Ca 0.01 -0.05 -0.03 0.00 0.77 0.00 0.00 66.41 67.11 1ce8 h THR 646 Cb 0.15 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.55 1ce8 h THR 646 CO 0.01 0.00 -0.14 1.55 0.37 0.00 0.00 175.52 177.31 1ce8 h PRO 647 N -1.32 0.00 -0.49 6.66 0.13 -1.72 -2.96 132.00 132.30 1ce8 h PRO 647 Ca -0.13 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.94 1ce8 h PRO 647 Cb 0.97 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.08 1ce8 h PRO 647 CO 0.21 0.14 0.06 1.25 -0.23 0.00 0.00 178.00 179.43 1ce8 h LEU 648 N 0.00 0.74 0.00 1.56 5.85 -1.32 -1.56 115.31 120.58 1ce8 h LEU 648 Ca -0.00 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.56 1ce8 h LEU 648 Cb 0.26 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.09 1ce8 h LEU 648 CO 0.02 0.78 0.00 0.29 -0.34 0.00 0.00 178.44 179.19 1ce8 n LYS 649 N -4.25 0.68 -0.05 1.25 5.02 -0.89 -3.09 118.16 116.82 1ce8 n LYS 649 Ca 0.03 0.01 -0.08 0.00 -2.02 0.00 0.00 58.31 56.25 1ce8 n LYS 649 Cb 0.26 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.63 1ce8 n LYS 649 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1ce8 n LEU 650 N -1.14 0.45 -0.19 -0.35 4.77 -0.62 -4.63 117.00 115.29 1ce8 n LEU 650 Ca 0.18 0.21 -0.05 0.00 -0.03 0.00 0.00 56.01 56.33 1ce8 n LEU 650 Cb 0.16 0.31 -0.04 0.00 -2.33 0.00 0.00 43.42 41.51 1ce8 n LEU 650 CO 0.19 0.41 0.29 0.00 -1.33 0.00 0.00 177.39 176.95 1ce8 n ALA 651 N -2.62 -0.29 0.32 -1.18 0.00 -1.01 -0.61 120.51 115.12 1ce8 n ALA 651 Ca -0.23 0.38 -0.18 0.00 0.00 0.00 0.00 53.44 53.41 1ce8 n ALA 651 Cb 1.07 0.01 -0.09 0.00 0.00 0.00 0.00 19.45 20.44 1ce8 n ALA 651 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ce8 h ARG 652 N 0.00 -0.91 -0.86 0.00 3.08 -1.82 -1.51 114.38 112.37 1ce8 h ARG 652 Ca 0.07 0.06 0.08 0.00 0.07 0.00 0.00 59.98 60.26 1ce8 h ARG 652 Cb 0.18 0.21 -0.06 0.00 0.08 0.00 0.00 29.97 30.38 1ce8 h ARG 652 CO -0.42 -0.60 0.56 0.00 -1.07 0.00 0.00 179.97 178.43 1ce8 h ALA 653 N -0.66 1.61 0.00 0.04 0.00 -1.72 -2.20 119.26 116.33 1ce8 h ALA 653 Ca -0.06 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1ce8 h ALA 653 Cb 0.79 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1ce8 h ALA 653 CO 0.02 0.25 -0.00 -0.07 0.00 0.00 0.00 179.25 179.44 1ce8 h LEU 654 N 0.91 -0.00 -0.71 0.00 3.38 -0.54 -2.58 115.31 115.77 1ce8 h LEU 654 Ca 0.38 -0.07 0.06 0.00 0.09 0.00 0.00 57.88 58.33 1ce8 h LEU 654 Cb 0.29 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 1ce8 h LEU 654 CO -0.15 0.07 0.41 -0.08 0.09 0.00 0.00 178.44 178.78 1ce8 h GLU 655 N -0.07 0.73 0.00 1.13 4.81 -0.97 -1.17 114.58 119.03 1ce8 h GLU 655 Ca -0.00 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 1ce8 h GLU 655 Cb 0.07 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.29 1ce8 h GLU 655 CO 0.00 0.48 -0.07 0.00 -0.73 0.00 0.00 179.01 178.69 1ce8 h ALA 656 N 1.35 1.78 0.00 2.92 0.00 -1.31 -0.48 119.26 123.53 1ce8 h ALA 656 Ca 0.31 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1ce8 h ALA 656 Cb 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ce8 h ALA 656 CO -0.17 0.09 -0.44 0.00 0.00 0.00 0.00 179.25 178.72 1ce8 n ALA 657 N -2.48 3.30 0.00 0.00 0.00 -0.75 -4.93 120.51 115.65 1ce8 n ALA 657 Ca -0.03 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1ce8 n ALA 657 Cb 0.15 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.43 1ce8 n ALA 657 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ce8 n GLY 658 N 1.48 1.14 3.60 0.00 0.00 -0.19 -5.10 105.19 106.13 1ce8 n GLY 658 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 1ce8 n GLY 658 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ce8 s VAL 659 N -2.00 5.12 -0.93 1.61 1.01 -0.52 -4.94 120.40 119.75 1ce8 s VAL 659 Ca 0.00 0.64 -0.24 0.00 0.00 0.00 0.00 61.98 62.38 1ce8 s VAL 659 Cb 0.00 -3.78 -0.16 0.00 0.00 0.00 0.00 36.38 32.44 1ce8 s VAL 659 CO 0.00 0.08 1.92 -2.65 0.00 0.00 0.00 175.10 174.45 1ce8 n PRO 660 N 5.45 1.21 -2.60 2.72 -0.02 -1.26 -4.35 135.00 136.15 1ce8 n PRO 660 Ca -0.06 -2.04 -0.43 0.00 -2.02 0.00 0.00 63.50 58.95 1ce8 n PRO 660 Cb 0.50 -3.39 -0.02 0.00 -0.02 0.00 0.00 33.50 30.57 1ce8 n PRO 660 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ce8 s VAL 661 N 9.67 4.28 0.69 -1.45 1.01 -1.26 -1.40 120.40 131.94 1ce8 s VAL 661 Ca 0.67 1.36 -0.02 0.00 0.00 0.00 0.00 61.98 63.99 1ce8 s VAL 661 Cb 0.05 -4.54 0.10 0.00 0.00 0.00 0.00 36.38 31.99 1ce8 s VAL 661 CO 0.16 -0.85 0.95 0.27 0.00 0.00 0.00 175.10 175.64 1ce8 s ILE 662 N 4.26 2.29 0.01 2.22 -4.36 -0.86 -4.87 121.20 119.89 1ce8 s ILE 662 Ca 0.48 -0.54 0.00 0.00 -0.26 0.00 0.00 60.65 60.33 1ce8 s ILE 662 Cb -0.09 -2.75 0.00 0.00 1.25 0.00 0.00 42.46 40.87 1ce8 s ILE 662 CO 0.27 0.00 0.00 0.61 0.24 0.00 0.00 174.94 176.06 1ce8 n GLY 663 N -2.76 -2.02 3.38 6.27 0.00 -1.26 -4.60 105.19 104.20 1ce8 n GLY 663 Ca 0.12 -1.40 -0.52 0.00 0.00 0.00 0.00 46.02 44.22 1ce8 n GLY 663 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ce8 n THR 664 N -0.42 0.08 -1.41 2.61 -1.04 -0.46 -4.78 114.28 108.86 1ce8 n THR 664 Ca 0.00 -0.16 -0.42 0.00 -2.04 0.00 0.00 64.05 61.43 1ce8 n THR 664 Cb 0.01 -1.12 0.00 0.00 -1.82 0.00 0.00 70.33 67.40 1ce8 n THR 664 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1ce8 n SER 665 N 9.38 -1.44 -0.20 8.00 3.41 -1.26 -4.60 113.62 126.92 1ce8 n SER 665 Ca 0.49 0.90 0.00 0.00 -0.26 0.00 0.00 58.87 60.01 1ce8 n SER 665 Cb 0.12 -1.04 0.25 0.00 -0.26 0.00 0.00 64.21 63.28 1ce8 n SER 665 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1ce8 h PRO 666 N 0.69 0.95 -0.18 4.33 0.11 -1.90 0.22 132.00 136.22 1ce8 h PRO 666 Ca -0.39 -0.07 -0.12 0.00 0.11 0.00 0.00 66.00 65.53 1ce8 h PRO 666 Cb 1.41 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1ce8 h PRO 666 CO 0.51 0.65 -0.41 0.22 -0.21 0.00 0.00 178.00 178.75 1ce8 h ASP 667 N 0.97 0.44 0.15 -2.05 3.58 -1.96 -1.91 116.42 115.64 1ce8 h ASP 667 Ca 0.26 -0.19 -0.01 0.00 0.42 0.00 0.00 57.03 57.51 1ce8 h ASP 667 Cb -0.07 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 40.86 1ce8 h ASP 667 CO -0.05 0.81 -0.07 0.00 -2.88 0.00 0.00 179.24 177.04 1ce8 h ALA 668 N 1.21 -0.21 -0.64 -0.78 0.00 -0.96 -0.60 119.26 117.29 1ce8 h ALA 668 Ca 0.03 -0.06 0.13 0.00 0.00 0.00 0.00 54.91 55.01 1ce8 h ALA 668 Cb 0.88 0.08 -0.12 0.00 0.00 0.00 0.00 17.79 18.63 1ce8 h ALA 668 CO 0.07 -0.59 -0.10 0.82 0.00 0.00 0.00 179.25 179.45 1ce8 h ILE 669 N -0.25 0.40 -0.18 0.00 2.04 -0.91 0.64 117.51 119.25 1ce8 h ILE 669 Ca -0.02 -0.01 -0.03 0.00 1.00 0.00 0.00 64.86 65.80 1ce8 h ILE 669 Cb 0.19 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 1ce8 h ILE 669 CO 0.03 0.01 -0.02 -0.78 0.00 0.00 0.00 178.15 177.40 1ce8 h ASP 670 N 0.04 0.24 -0.21 1.72 3.58 -0.84 -1.07 116.42 119.88 1ce8 h ASP 670 Ca 0.32 -0.03 0.02 0.00 0.42 0.00 0.00 57.03 57.76 1ce8 h ASP 670 Cb 0.51 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 41.48 1ce8 h ASP 670 CO -0.62 0.30 0.08 -0.09 -2.88 0.00 0.00 179.24 176.03 1ce8 h ARG 671 N 0.26 0.17 -0.24 0.28 2.43 0.19 0.38 114.38 117.84 1ce8 h ARG 671 Ca 0.06 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.24 1ce8 h ARG 671 Cb 0.20 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.69 1ce8 h ARG 671 CO 0.01 0.11 0.12 0.00 -1.51 0.00 0.00 179.97 178.70 1ce8 h ALA 672 N 1.13 0.29 -0.41 2.80 0.00 -0.89 -1.56 119.26 120.61 1ce8 h ALA 672 Ca 0.09 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 1ce8 h ALA 672 Cb 0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1ce8 h ALA 672 CO -0.09 -0.29 -0.27 0.93 0.00 0.00 0.00 179.25 179.53 1ce8 h GLU 673 N 0.25 0.92 -6.23 0.00 4.39 -0.80 -3.40 114.58 109.71 1ce8 h GLU 673 Ca 0.10 -0.43 -0.57 0.00 0.34 0.00 0.00 59.36 58.80 1ce8 h GLU 673 Cb 0.03 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 1ce8 h GLU 673 CO -0.07 1.09 1.25 0.34 -1.16 0.00 0.00 179.01 180.46 1ce8 s ASP 674 N -6.71 6.08 0.63 1.42 2.15 0.13 -4.81 116.67 115.56 1ce8 s ASP 674 Ca -0.12 1.75 0.20 0.00 0.43 0.00 0.00 52.55 54.81 1ce8 s ASP 674 Cb 0.11 -2.53 0.90 0.00 -0.30 0.00 0.00 42.92 41.10 1ce8 s ASP 674 CO 0.86 -1.48 1.45 0.08 -0.17 0.00 0.00 175.17 175.91 1ce8 h ARG 675 N 12.13 0.00 0.03 4.34 -0.00 -1.86 0.10 114.38 129.13 1ce8 h ARG 675 Ca -0.37 0.00 -0.38 0.00 -0.00 0.00 0.00 59.98 59.22 1ce8 h ARG 675 Cb 1.19 0.00 -0.05 0.00 -0.00 0.00 0.00 29.97 31.10 1ce8 h ARG 675 CO 0.99 0.00 -2.24 0.39 -0.00 0.00 0.00 179.97 179.11 1ce8 n GLU 676 N -3.05 0.66 -0.37 0.08 1.02 -1.26 -3.76 120.64 113.96 1ce8 n GLU 676 Ca 0.09 0.24 -0.02 0.00 -0.02 0.00 0.00 57.16 57.45 1ce8 n GLU 676 Cb 0.98 -1.59 0.11 0.00 -0.02 0.00 0.00 31.44 30.93 1ce8 n GLU 676 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ce8 h ARG 677 N -0.26 1.32 0.13 3.49 3.08 -1.18 -2.62 114.38 118.34 1ce8 h ARG 677 Ca -0.54 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 59.42 1ce8 h ARG 677 Cb 1.83 -0.29 0.00 0.00 0.08 0.00 0.00 29.97 31.58 1ce8 h ARG 677 CO -0.12 0.88 -0.06 0.35 -1.07 0.00 0.00 179.97 179.95 1ce8 h PHE 678 N 1.36 -0.17 -0.70 3.04 3.57 0.17 -3.09 116.94 121.12 1ce8 h PHE 678 Ca 0.36 -0.00 0.14 0.00 3.53 0.00 0.00 57.97 61.99 1ce8 h PHE 678 Cb -0.14 0.05 -0.13 0.00 2.79 0.00 0.00 35.95 38.52 1ce8 h PHE 678 CO 0.00 0.11 -0.22 0.37 -2.23 0.00 0.00 178.31 176.34 1ce8 h GLN 679 N -0.43 -0.04 0.19 1.11 4.15 -1.60 -1.46 115.11 117.03 1ce8 h GLN 679 Ca -0.02 0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.41 1ce8 h GLN 679 Cb 0.35 0.01 -0.04 0.00 0.21 0.00 0.00 27.48 28.00 1ce8 h GLN 679 CO 0.03 -0.03 -0.48 0.45 -1.93 0.00 0.00 178.83 176.87 1ce8 h HIS 680 N -0.04 -1.37 -0.98 3.99 3.86 -1.48 0.71 115.15 119.85 1ce8 h HIS 680 Ca 0.32 0.03 0.30 0.00 -1.16 0.00 0.00 60.37 59.86 1ce8 h HIS 680 Cb 0.54 0.57 -0.15 0.00 1.06 0.00 0.00 27.41 29.43 1ce8 h HIS 680 CO -0.60 -0.58 0.50 0.00 0.86 0.00 0.00 177.93 178.11 1ce8 h ALA 681 N -0.45 1.80 0.06 2.45 0.00 -1.25 1.60 119.26 123.46 1ce8 h ALA 681 Ca -0.01 0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1ce8 h ALA 681 Cb 0.75 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1ce8 h ALA 681 CO -0.23 -0.52 -0.03 0.28 0.00 0.00 0.00 179.25 178.75 1ce8 h VAL 682 N 0.32 1.14 -0.46 0.00 2.07 -0.13 0.60 116.25 119.80 1ce8 h VAL 682 Ca 0.69 -0.67 0.13 0.00 0.82 0.00 0.00 66.70 67.67 1ce8 h VAL 682 Cb 1.52 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 32.85 1ce8 h VAL 682 CO -0.61 0.17 0.39 -0.33 0.02 0.00 0.00 177.57 177.21 1ce8 h GLU 683 N -0.38 0.00 0.00 1.57 5.08 0.73 0.49 114.58 122.07 1ce8 h GLU 683 Ca -0.01 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1ce8 h GLU 683 Cb 0.34 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 1ce8 h GLU 683 CO 0.01 0.00 -0.08 -0.09 -1.00 0.00 0.00 179.01 177.85 1ce8 h ARG 684 N 0.00 0.00 0.00 2.33 2.43 0.30 -3.33 114.38 116.11 1ce8 h ARG 684 Ca 0.22 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 1ce8 h ARG 684 Cb 0.99 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.54 1ce8 h ARG 684 CO -0.00 0.84 0.00 1.28 -1.51 0.00 0.00 179.97 180.58 1ce8 n LEU 685 N -4.62 0.00 -3.51 3.80 4.77 0.20 -4.89 117.00 112.75 1ce8 n LEU 685 Ca -0.10 0.29 -0.18 0.00 -0.03 0.00 0.00 56.01 55.98 1ce8 n LEU 685 Cb 0.42 -0.29 0.07 0.00 -2.33 0.00 0.00 43.42 41.29 1ce8 n LEU 685 CO 0.28 -0.10 0.04 0.29 -1.33 0.00 0.00 177.39 176.57 1ce8 n LYS 686 N -1.29 -5.67 -4.05 3.23 5.02 0.11 -5.00 118.16 110.51 1ce8 n LYS 686 Ca 0.09 0.77 -0.22 0.00 -2.02 0.00 0.00 58.31 56.94 1ce8 n LYS 686 Cb 0.16 -5.61 -0.03 0.00 -0.02 0.00 0.00 35.03 29.52 1ce8 n LYS 686 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1ce8 s LEU 687 N -6.39 4.04 -0.40 -0.35 1.43 -1.01 -5.06 118.68 110.93 1ce8 s LEU 687 Ca 0.04 -0.11 -0.21 0.00 -1.03 0.00 0.00 54.13 52.83 1ce8 s LEU 687 Cb -0.01 -2.57 0.01 0.00 0.03 0.00 0.00 46.19 43.65 1ce8 s LEU 687 CO 0.76 -0.05 0.64 -0.75 0.23 0.00 0.00 176.35 177.18 1ce8 s LYS 688 N -3.88 3.48 0.09 1.70 2.20 -1.26 -4.78 119.74 117.28 1ce8 s LYS 688 Ca 0.33 -0.16 0.07 0.00 -0.36 0.00 0.00 55.97 55.85 1ce8 s LYS 688 Cb -0.08 -3.88 -0.04 0.00 -1.51 0.00 0.00 37.83 32.32 1ce8 s LYS 688 CO 0.27 -0.88 -0.12 -1.14 -0.36 0.00 0.00 175.35 173.12 1ce8 s GLN 689 N 2.77 2.12 0.55 4.03 0.74 -1.26 0.07 119.66 128.68 1ce8 s GLN 689 Ca 0.23 -1.00 -0.21 0.00 0.05 0.00 0.00 55.36 54.43 1ce8 s GLN 689 Cb -0.14 -2.29 -0.05 0.00 1.10 0.00 0.00 33.01 31.64 1ce8 s GLN 689 CO 0.17 0.52 1.26 -2.14 -0.55 0.00 0.00 175.29 174.55 1ce8 s PRO 690 N -2.01 3.16 -0.25 1.67 0.02 -1.26 -4.85 135.00 131.48 1ce8 s PRO 690 Ca 0.20 1.97 -0.28 0.00 0.02 0.00 0.00 61.00 62.91 1ce8 s PRO 690 Cb -0.11 -2.13 -0.04 0.00 0.02 0.00 0.00 34.50 32.24 1ce8 s PRO 690 CO 0.11 -1.09 2.12 0.00 -0.33 0.00 0.00 177.00 177.81 1ce8 s ALA 691 N -1.47 2.75 0.49 -1.55 0.00 -1.26 -4.78 121.76 115.95 1ce8 s ALA 691 Ca 0.73 0.66 0.06 0.00 0.00 0.00 0.00 51.96 53.41 1ce8 s ALA 691 Cb -0.34 -4.06 0.06 0.00 0.00 0.00 0.00 23.12 18.78 1ce8 s ALA 691 CO 0.39 -2.77 0.52 0.27 0.00 0.00 0.00 175.76 174.17 1ce8 n ASN 692 N 11.39 2.20 -3.12 0.00 2.04 -1.26 -1.08 115.26 125.43 1ce8 n ASN 692 Ca 0.28 -2.50 0.06 0.00 -0.44 0.00 0.00 54.58 51.98 1ce8 n ASN 692 Cb 0.45 -0.20 0.00 0.00 -2.53 0.00 0.00 39.78 37.51 1ce8 n ASN 692 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1ce8 s ALA 693 N -2.65 -4.44 -0.07 -2.53 0.00 0.12 -4.92 121.76 107.27 1ce8 s ALA 693 Ca 0.40 1.43 -0.30 0.00 0.00 0.00 0.00 51.96 53.48 1ce8 s ALA 693 Cb -0.03 -2.91 -0.04 0.00 0.00 0.00 0.00 23.12 20.13 1ce8 s ALA 693 CO 0.25 -2.18 1.43 0.99 0.00 0.00 0.00 175.76 176.25 1ce8 s THR 694 N 2.92 3.87 0.20 0.00 2.01 -1.26 -2.56 115.64 120.83 1ce8 s THR 694 Ca 0.31 1.13 0.11 0.00 0.31 0.00 0.00 61.69 63.55 1ce8 s THR 694 Cb 0.00 -3.73 -0.04 0.00 0.01 0.00 0.00 72.50 68.74 1ce8 s THR 694 CO -0.22 -0.07 -0.22 -0.69 -0.69 0.00 0.00 174.62 172.73 1ce8 s VAL 695 N 3.28 2.27 0.04 3.82 1.01 -0.83 -4.98 120.40 125.01 1ce8 s VAL 695 Ca 0.64 -2.08 -0.01 0.00 0.00 0.00 0.00 61.98 60.53 1ce8 s VAL 695 Cb -0.29 -2.10 -0.00 0.00 0.00 0.00 0.00 36.38 33.99 1ce8 s VAL 695 CO 0.23 -0.21 -0.02 0.41 0.00 0.00 0.00 175.10 175.52 1ce8 n THR 696 N 0.11 0.67 -2.84 3.92 -1.04 -1.26 -0.09 114.28 113.74 1ce8 n THR 696 Ca -0.11 0.22 -0.32 0.00 -2.04 0.00 0.00 64.05 61.81 1ce8 n THR 696 Cb 0.57 -1.37 -0.05 0.00 -1.82 0.00 0.00 70.33 67.66 1ce8 n THR 696 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ce8 s ALA 697 N -2.09 3.24 0.06 2.41 0.00 -1.26 -4.91 121.76 119.22 1ce8 s ALA 697 Ca -0.01 0.03 -0.23 0.00 0.00 0.00 0.00 51.96 51.74 1ce8 s ALA 697 Cb 0.00 -2.87 -0.11 0.00 0.00 0.00 0.00 23.12 20.15 1ce8 s ALA 697 CO 0.02 0.07 1.36 0.82 0.00 0.00 0.00 175.76 178.03 1ce8 h ILE 698 N 1.43 0.00 -0.80 0.00 5.03 -2.01 -2.86 117.51 118.30 1ce8 h ILE 698 Ca -0.48 0.00 0.21 0.00 -0.12 0.00 0.00 64.86 64.47 1ce8 h ILE 698 Cb 1.18 0.00 -0.04 0.00 -3.03 0.00 0.00 36.82 34.93 1ce8 h ILE 698 CO 0.63 0.00 0.56 -0.33 -0.68 0.00 0.00 178.15 178.33 1ce8 h GLU 699 N -0.61 0.16 0.09 2.37 4.39 -1.99 -0.87 114.58 118.13 1ce8 h GLU 699 Ca -0.03 -0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.68 1ce8 h GLU 699 Cb 0.55 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.14 1ce8 h GLU 699 CO -0.09 0.11 -0.19 1.98 -1.16 0.00 0.00 179.01 179.66 1ce8 h MET 700 N 0.17 -0.34 0.37 2.33 4.05 -1.91 -2.63 114.93 116.96 1ce8 h MET 700 Ca 0.39 0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.83 1ce8 h MET 700 Cb 1.30 0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 32.15 1ce8 h MET 700 CO -0.07 -0.23 -0.51 0.00 0.23 0.00 0.00 176.91 176.34 1ce8 h ALA 701 N 0.48 -1.10 -0.68 0.39 0.00 -1.03 0.10 119.26 117.42 1ce8 h ALA 701 Ca 0.03 -0.16 0.20 0.00 0.00 0.00 0.00 54.91 54.97 1ce8 h ALA 701 Cb 0.38 0.78 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 1ce8 h ALA 701 CO -0.11 -1.16 1.11 0.28 0.00 0.00 0.00 179.25 179.37 1ce8 n VAL 702 N -5.45 0.00 -0.11 0.00 0.31 -1.01 0.26 118.33 112.34 1ce8 n VAL 702 Ca -0.11 1.13 -0.16 0.00 -0.01 0.00 0.00 64.34 65.19 1ce8 n VAL 702 Cb 0.44 -2.09 -0.06 0.00 -0.91 0.00 0.00 33.84 31.23 1ce8 n VAL 702 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1ce8 n GLU 703 N -2.93 0.55 -0.20 5.55 4.07 -0.81 -3.53 120.64 123.34 1ce8 n GLU 703 Ca 0.15 0.25 0.23 0.00 -0.06 0.00 0.00 57.16 57.74 1ce8 n GLU 703 Cb 1.31 -1.47 0.61 0.00 -0.06 0.00 0.00 31.44 31.84 1ce8 n GLU 703 CO 0.00 0.00 0.00 -0.22 -0.06 0.00 0.00 177.13 176.85 1ce8 h LYS 704 N -1.00 0.20 0.09 5.31 1.63 0.19 0.94 116.57 123.94 1ce8 h LYS 704 Ca -0.25 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.53 1ce8 h LYS 704 Cb 1.20 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.78 1ce8 h LYS 704 CO -0.15 0.13 -0.04 0.00 -3.45 0.00 0.00 179.45 175.93 1ce8 h ALA 705 N 1.60 -0.12 0.00 5.00 0.00 0.35 -1.29 119.26 124.79 1ce8 h ALA 705 Ca 0.44 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1ce8 h ALA 705 Cb 1.39 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.23 1ce8 h ALA 705 CO -0.10 -0.54 0.01 -0.22 0.00 0.00 0.00 179.25 178.40 1ce8 h LYS 706 N -0.19 0.00 0.00 0.00 1.63 0.79 0.25 116.57 119.06 1ce8 h LYS 706 Ca -0.01 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1ce8 h LYS 706 Cb 0.15 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.78 1ce8 h LYS 706 CO 0.02 0.00 -0.20 0.93 -3.45 0.00 0.00 179.45 176.75 1ce8 h GLU 707 N 0.00 0.00 -0.05 1.90 5.08 -0.51 -3.41 114.58 117.60 1ce8 h GLU 707 Ca 0.00 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1ce8 h GLU 707 Cb 0.01 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.20 1ce8 h GLU 707 CO 0.00 0.00 -0.50 0.82 -1.00 0.00 0.00 179.01 178.33 1ce8 h ILE 708 N -0.90 0.05 0.00 3.13 5.03 -0.86 -3.49 117.51 120.47 1ce8 h ILE 708 Ca 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.74 1ce8 h ILE 708 Cb 0.20 0.05 0.00 0.00 -3.03 0.00 0.00 36.82 34.04 1ce8 h ILE 708 CO 0.00 0.00 0.00 0.61 -0.68 0.00 0.00 178.15 178.08 1ce8 n GLY 709 N -1.45 2.60 3.83 5.37 0.00 0.04 -4.89 105.19 110.69 1ce8 n GLY 709 Ca -0.06 -1.36 -0.32 0.00 0.00 0.00 0.00 46.02 44.28 1ce8 n GLY 709 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ce8 s TYR 710 N -0.00 3.29 1.00 1.61 2.02 -1.26 -4.44 117.35 119.57 1ce8 s TYR 710 Ca 0.00 1.42 -0.13 0.00 -0.37 0.00 0.00 57.07 57.98 1ce8 s TYR 710 Cb 0.00 -2.85 0.19 0.00 -0.40 0.00 0.00 41.96 38.90 1ce8 s TYR 710 CO 0.00 -0.87 1.12 -1.25 -1.57 0.00 0.00 175.55 172.98 1ce8 s PRO 711 N -4.64 0.45 0.01 -1.71 0.04 -1.26 -4.90 135.00 122.99 1ce8 s PRO 711 Ca 0.59 0.29 0.04 0.00 0.04 0.00 0.00 61.00 61.96 1ce8 s PRO 711 Cb -0.13 -1.76 -0.01 0.00 0.04 0.00 0.00 34.50 32.64 1ce8 s PRO 711 CO 0.45 -2.67 -0.12 -0.51 0.04 0.00 0.00 177.00 174.19 1ce8 s LEU 712 N -6.35 2.07 -0.19 -3.56 1.02 0.48 -0.48 118.68 111.67 1ce8 s LEU 712 Ca 0.66 -0.29 -0.17 0.00 0.02 0.00 0.00 54.13 54.35 1ce8 s LEU 712 Cb -0.15 -0.60 -0.04 0.00 0.02 0.00 0.00 46.19 45.42 1ce8 s LEU 712 CO 0.55 0.11 0.46 -0.69 0.02 0.00 0.00 176.35 176.80 1ce8 s VAL 713 N -0.46 5.16 -0.55 -1.59 1.01 0.33 0.11 120.40 124.41 1ce8 s VAL 713 Ca 0.03 0.84 -0.04 0.00 0.00 0.00 0.00 61.98 62.81 1ce8 s VAL 713 Cb -0.06 -3.79 0.14 0.00 0.00 0.00 0.00 36.38 32.68 1ce8 s VAL 713 CO 0.00 0.22 0.38 -0.69 0.00 0.00 0.00 175.10 175.01 1ce8 s VAL 714 N 1.41 3.78 -0.03 2.92 1.01 0.11 -1.72 120.40 127.88 1ce8 s VAL 714 Ca 0.22 -2.49 -0.17 0.00 0.00 0.00 0.00 61.98 59.54 1ce8 s VAL 714 Cb -0.15 -3.49 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 1ce8 s VAL 714 CO 0.09 -0.82 0.48 -0.13 0.00 0.00 0.00 175.10 174.73 1ce8 s ARG 715 N 0.52 4.17 -0.10 2.72 0.52 -0.70 -2.84 118.95 123.24 1ce8 s ARG 715 Ca 0.13 0.52 -0.10 0.00 -0.52 0.00 0.00 55.73 55.76 1ce8 s ARG 715 Cb -0.21 -3.31 -0.03 0.00 0.52 0.00 0.00 34.95 31.91 1ce8 s ARG 715 CO -0.04 0.45 -0.20 -0.35 0.02 0.00 0.00 175.30 175.19 1ce8 n PRO 716 N 2.56 0.30 -1.78 3.54 -0.05 -1.26 -0.27 135.00 138.04 1ce8 n PRO 716 Ca -0.10 0.12 0.00 0.00 -0.05 0.00 0.00 63.50 63.47 1ce8 n PRO 716 Cb 0.52 -1.02 0.00 0.00 -0.05 0.00 0.00 33.50 32.95 1ce8 n PRO 716 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1ce8 n ALA 724 N -3.62 -1.41 -2.22 0.55 0.00 -1.26 -4.49 120.51 108.05 1ce8 n ALA 724 Ca -0.08 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.98 1ce8 n ALA 724 Cb 0.29 -0.25 -0.06 0.00 0.00 0.00 0.00 19.45 19.44 1ce8 n ALA 724 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ce8 s MET 725 N -0.41 4.22 0.00 0.00 0.00 -1.26 -5.02 119.30 116.82 1ce8 s MET 725 Ca 0.00 0.77 0.00 0.00 0.00 0.00 0.00 55.69 56.46 1ce8 s MET 725 Cb 0.00 -3.13 -0.00 0.00 0.00 0.00 0.00 34.83 31.70 1ce8 s MET 725 CO 0.00 0.56 -0.01 -2.00 0.00 0.00 0.00 175.02 173.58 1ce8 s GLU 726 N -1.41 0.05 -0.32 3.16 2.12 -1.13 -4.83 118.70 116.34 1ce8 s GLU 726 Ca 0.34 -0.05 -0.23 0.00 0.36 0.00 0.00 54.97 55.38 1ce8 s GLU 726 Cb -0.19 -0.02 0.00 0.00 0.26 0.00 0.00 34.13 34.18 1ce8 s GLU 726 CO 0.20 0.00 0.79 0.42 -0.54 0.00 0.00 175.26 176.14 1ce8 s ILE 727 N -0.11 4.77 -0.19 -3.70 1.01 -1.26 0.09 121.20 121.81 1ce8 s ILE 727 Ca -0.01 1.11 -0.07 0.00 0.00 0.00 0.00 60.65 61.68 1ce8 s ILE 727 Cb -0.01 -4.16 -0.04 0.00 0.01 0.00 0.00 42.46 38.26 1ce8 s ILE 727 CO -0.00 -0.30 0.06 -0.69 0.00 0.00 0.00 174.94 174.01 1ce8 s VAL 728 N 3.00 4.71 -0.11 2.92 1.01 0.30 -4.81 120.40 127.42 1ce8 s VAL 728 Ca 0.32 -0.06 -0.02 0.00 0.00 0.00 0.00 61.98 62.22 1ce8 s VAL 728 Cb -0.14 -3.13 -0.25 0.00 0.00 0.00 0.00 36.38 32.86 1ce8 s VAL 728 CO 0.14 0.44 0.39 -1.22 0.00 0.00 0.00 175.10 174.85 1ce8 n TYR 729 N 3.77 1.13 -4.22 5.22 4.02 -1.26 0.18 117.16 126.00 1ce8 n TYR 729 Ca -0.16 0.27 -0.18 0.00 -0.01 0.00 0.00 57.90 57.82 1ce8 n TYR 729 Cb 0.52 -1.16 -0.07 0.00 -0.02 0.00 0.00 39.34 38.61 1ce8 n TYR 729 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 176.86 176.01 1ce8 s ASP 730 N -6.81 1.36 0.15 7.72 1.47 -1.26 -4.46 116.67 114.84 1ce8 s ASP 730 Ca -0.19 -1.66 -0.20 0.00 1.18 0.00 0.00 52.55 51.68 1ce8 s ASP 730 Cb 0.07 0.57 0.03 0.00 -0.34 0.00 0.00 42.92 43.25 1ce8 s ASP 730 CO 0.77 -1.11 1.66 -0.08 0.68 0.00 0.00 175.17 177.10 1ce8 h GLU 731 N 2.16 -0.11 -0.07 2.11 4.81 -1.97 0.81 114.58 122.32 1ce8 h GLU 731 Ca -0.27 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.01 1ce8 h GLU 731 Cb 1.24 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.59 1ce8 h GLU 731 CO 0.38 -0.07 -0.20 0.00 -0.73 0.00 0.00 179.01 178.39 1ce8 h ALA 732 N 1.07 -0.20 -0.67 2.92 0.00 -2.01 -1.65 119.26 118.73 1ce8 h ALA 732 Ca 0.14 0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.20 1ce8 h ALA 732 Cb 0.32 0.37 -0.13 0.00 0.00 0.00 0.00 17.79 18.35 1ce8 h ALA 732 CO -0.32 -0.67 -0.20 0.22 0.00 0.00 0.00 179.25 178.28 1ce8 h ASP 733 N -0.28 -0.71 -0.23 0.00 3.58 -1.72 -1.95 116.42 115.10 1ce8 h ASP 733 Ca 0.08 0.21 0.02 0.00 0.42 0.00 0.00 57.03 57.76 1ce8 h ASP 733 Cb 0.40 0.45 -0.04 0.00 1.72 0.00 0.00 39.33 41.86 1ce8 h ASP 733 CO -0.24 -0.24 -0.23 0.25 -2.88 0.00 0.00 179.24 175.91 1ce8 h LEU 734 N -0.03 -0.78 -0.38 2.28 5.85 0.10 -0.38 115.31 121.98 1ce8 h LEU 734 Ca 0.31 0.11 0.07 0.00 0.84 0.00 0.00 57.88 59.21 1ce8 h LEU 734 Cb 0.51 0.33 -0.09 0.00 0.37 0.00 0.00 40.66 41.78 1ce8 h LEU 734 CO -0.70 -0.14 -0.36 0.03 -0.34 0.00 0.00 178.44 176.93 1ce8 h ARG 735 N -0.11 -0.28 -0.75 1.25 3.08 -1.21 -0.80 114.38 115.56 1ce8 h ARG 735 Ca 0.04 0.02 0.14 0.00 0.07 0.00 0.00 59.98 60.25 1ce8 h ARG 735 Cb 0.22 0.06 -0.14 0.00 0.08 0.00 0.00 29.97 30.19 1ce8 h ARG 735 CO -0.28 -0.19 -0.24 -0.09 -1.07 0.00 0.00 179.97 178.11 1ce8 h ARG 736 N -0.29 -0.03 0.40 0.04 2.43 -0.83 0.19 114.38 116.28 1ce8 h ARG 736 Ca 0.15 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.31 1ce8 h ARG 736 Cb 0.56 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 1ce8 h ARG 736 CO -0.54 -0.02 -0.21 -0.92 -1.51 0.00 0.00 179.97 176.78 1ce8 h TYR 737 N -0.04 -0.54 -1.19 2.20 3.20 0.24 -2.86 116.97 117.98 1ce8 h TYR 737 Ca 0.34 -0.01 0.43 0.00 3.14 0.00 0.00 58.73 62.63 1ce8 h TYR 737 Cb 0.56 0.18 -0.15 0.00 1.54 0.00 0.00 36.73 38.86 1ce8 h TYR 737 CO -0.63 -0.33 0.72 0.74 -1.64 0.00 0.00 178.16 177.02 1ce8 h PHE 738 N -0.56 0.67 0.71 -3.82 0.04 0.57 -0.21 116.94 114.35 1ce8 h PHE 738 Ca -0.05 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.72 1ce8 h PHE 738 Cb 0.44 -0.16 0.01 0.00 2.20 0.00 0.00 35.95 38.44 1ce8 h PHE 738 CO -0.06 -0.32 -0.34 0.37 -0.60 0.00 0.00 178.31 177.35 1ce8 h GLN 739 N 0.06 -0.92 -0.10 1.51 4.15 -0.70 -3.00 115.11 116.10 1ce8 h GLN 739 Ca 0.84 0.06 0.03 0.00 0.77 0.00 0.00 58.65 60.35 1ce8 h GLN 739 Cb 2.44 0.21 -0.00 0.00 0.21 0.00 0.00 27.48 30.33 1ce8 h GLN 739 CO -0.58 -0.61 0.14 1.79 -1.93 0.00 0.00 178.83 177.63 1ce8 h THR 740 N -1.13 0.39 -0.06 2.39 1.35 -1.32 -3.52 112.91 111.01 1ce8 h THR 740 Ca -0.10 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.76 1ce8 h THR 740 Cb 0.73 0.89 0.00 0.00 -1.73 0.00 0.00 68.15 68.04 1ce8 h THR 740 CO 0.16 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.43 1ce8 n ALA 741 N -2.26 0.00 0.00 6.62 0.00 -0.20 -5.14 120.51 119.53 1ce8 n ALA 741 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ce8 n ALA 741 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.68 1ce8 n ALA 741 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ce8 n VAL 750 N -0.16 0.00 -2.27 0.00 0.31 0.87 -4.96 118.33 112.12 1ce8 n VAL 750 Ca 0.00 0.00 -0.37 0.00 -0.01 0.00 0.00 64.34 63.96 1ce8 n VAL 750 Cb 0.00 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 32.92 1ce8 n VAL 750 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1ce8 s LEU 751 N 0.00 4.01 -0.06 7.52 1.02 0.62 -1.97 118.68 129.82 1ce8 s LEU 751 Ca 0.00 2.29 0.01 0.00 0.02 0.00 0.00 54.13 56.45 1ce8 s LEU 751 Cb 0.00 -4.25 0.02 0.00 0.02 0.00 0.00 46.19 41.98 1ce8 s LEU 751 CO 0.00 -0.91 -0.07 -0.76 0.02 0.00 0.00 176.35 174.63 1ce8 s LEU 752 N -3.04 1.38 0.09 1.79 1.02 -1.06 -1.72 118.68 117.14 1ce8 s LEU 752 Ca 0.64 -0.20 0.04 0.00 0.02 0.00 0.00 54.13 54.63 1ce8 s LEU 752 Cb -0.28 -0.62 -0.03 0.00 0.02 0.00 0.00 46.19 45.28 1ce8 s LEU 752 CO 0.34 -0.04 -0.12 -1.81 0.02 0.00 0.00 176.35 174.74 1ce8 s ASP 753 N 0.97 1.60 0.17 2.29 1.11 -0.70 0.14 116.67 122.25 1ce8 s ASP 753 Ca -0.10 -0.75 -0.30 0.00 0.18 0.00 0.00 52.55 51.59 1ce8 s ASP 753 Cb -0.15 -0.02 -0.07 0.00 1.07 0.00 0.00 42.92 43.75 1ce8 s ASP 753 CO 0.00 -0.18 0.97 -2.28 1.18 0.00 0.00 175.17 174.86 1ce8 s HIS 754 N -2.02 3.85 -0.50 4.23 5.65 -0.24 -0.51 115.29 125.75 1ce8 s HIS 754 Ca 0.03 1.82 -0.26 0.00 0.25 0.00 0.00 55.06 56.91 1ce8 s HIS 754 Cb -0.06 -3.05 0.03 0.00 -1.18 0.00 0.00 32.58 28.32 1ce8 s HIS 754 CO 0.01 0.21 0.98 0.12 -0.65 0.00 0.00 174.74 175.41 1ce8 s PHE 755 N -0.47 2.84 -0.85 3.88 5.36 0.36 -4.72 117.98 124.39 1ce8 s PHE 755 Ca 0.45 0.29 -0.25 0.00 -0.96 0.00 0.00 56.93 56.46 1ce8 s PHE 755 Cb -0.25 -4.11 -0.04 0.00 -0.34 0.00 0.00 43.02 38.29 1ce8 s PHE 755 CO 0.31 -1.25 1.92 -0.51 -1.46 0.00 0.00 175.22 174.23 1ce8 s LEU 756 N 4.01 3.20 0.56 6.12 1.43 -1.26 -4.50 118.68 128.24 1ce8 s LEU 756 Ca 0.37 -0.49 -0.17 0.00 -1.03 0.00 0.00 54.13 52.80 1ce8 s LEU 756 Cb -0.10 -2.55 -0.05 0.00 0.03 0.00 0.00 46.19 43.51 1ce8 s LEU 756 CO 0.25 -2.64 1.05 -0.62 0.23 0.00 0.00 176.35 174.62 1ce8 s ASP 757 N 7.96 5.95 -1.58 2.29 -1.08 -1.26 -3.89 116.67 125.05 1ce8 s ASP 757 Ca 0.69 1.85 -0.11 0.00 -0.52 0.00 0.00 52.55 54.46 1ce8 s ASP 757 Cb -0.08 -2.54 0.09 0.00 -1.46 0.00 0.00 42.92 38.93 1ce8 s ASP 757 CO 0.03 -1.05 0.60 0.47 0.52 0.00 0.00 175.17 175.75 1ce8 n ASP 758 N -1.72 -1.96 -4.57 -0.34 9.92 -1.26 -4.98 116.55 111.64 1ce8 n ASP 758 Ca 0.09 -1.02 -0.30 0.00 -0.53 0.00 0.00 54.79 53.02 1ce8 n ASP 758 Cb 0.53 -2.81 -0.10 0.00 -0.64 0.00 0.00 41.12 38.10 1ce8 n ASP 758 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ce8 s ALA 759 N -3.61 2.92 -0.04 2.24 0.00 -1.25 -4.82 121.76 117.21 1ce8 s ALA 759 Ca 0.42 -1.22 -0.18 0.00 0.00 0.00 0.00 51.96 50.99 1ce8 s ALA 759 Cb -0.23 -0.90 -0.05 0.00 0.00 0.00 0.00 23.12 21.94 1ce8 s ALA 759 CO 0.92 0.63 0.50 0.08 0.00 0.00 0.00 175.76 177.89 1ce8 s VAL 760 N -1.16 5.02 -0.07 0.00 1.01 -0.51 -1.83 120.40 122.86 1ce8 s VAL 760 Ca 0.20 1.02 -0.06 0.00 0.00 0.00 0.00 61.98 63.15 1ce8 s VAL 760 Cb -0.11 -3.83 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 1ce8 s VAL 760 CO 0.12 0.45 0.17 -0.70 0.00 0.00 0.00 175.10 175.14 1ce8 s GLU 761 N -0.25 3.47 0.04 2.72 2.12 -1.26 0.13 118.70 125.67 1ce8 s GLU 761 Ca 0.27 -0.17 0.04 0.00 0.36 0.00 0.00 54.97 55.47 1ce8 s GLU 761 Cb -0.17 -3.15 -0.02 0.00 0.26 0.00 0.00 34.13 31.05 1ce8 s GLU 761 CO 0.14 0.73 -0.13 0.08 -0.54 0.00 0.00 175.26 175.54 1ce8 s VAL 762 N -1.15 1.03 -0.07 3.70 1.01 -0.83 -1.55 120.40 122.54 1ce8 s VAL 762 Ca 0.20 -0.98 0.04 0.00 0.00 0.00 0.00 61.98 61.24 1ce8 s VAL 762 Cb -0.12 -0.95 -0.02 0.00 0.00 0.00 0.00 36.38 35.29 1ce8 s VAL 762 CO 0.10 -0.03 -0.19 -1.81 0.00 0.00 0.00 175.10 173.17 1ce8 s ASP 763 N -1.15 3.56 -0.11 3.32 1.01 0.56 -1.67 116.67 122.18 1ce8 s ASP 763 Ca 0.01 -0.38 -0.01 0.00 0.71 0.00 0.00 52.55 52.88 1ce8 s ASP 763 Cb -0.08 -1.00 0.03 0.00 1.01 0.00 0.00 42.92 42.88 1ce8 s ASP 763 CO 0.01 0.26 -0.03 -0.69 0.21 0.00 0.00 175.17 174.93 1ce8 s VAL 764 N -0.22 0.72 -0.13 -1.27 1.01 0.21 0.39 120.40 121.10 1ce8 s VAL 764 Ca -0.01 -0.20 -0.06 0.00 0.00 0.00 0.00 61.98 61.72 1ce8 s VAL 764 Cb -0.13 -0.87 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 1ce8 s VAL 764 CO 0.03 0.23 0.08 -1.81 0.00 0.00 0.00 175.10 173.63 1ce8 s ASP 765 N 1.82 5.84 0.05 3.32 1.01 -0.58 0.32 116.67 128.45 1ce8 s ASP 765 Ca 0.04 0.25 -0.12 0.00 0.71 0.00 0.00 52.55 53.43 1ce8 s ASP 765 Cb -0.13 -1.88 0.01 0.00 1.01 0.00 0.00 42.92 41.93 1ce8 s ASP 765 CO -0.07 0.31 0.26 0.00 0.21 0.00 0.00 175.17 175.88 1ce8 s ALA 766 N -0.47 -0.53 -0.01 5.23 0.00 0.10 -0.83 121.76 125.25 1ce8 s ALA 766 Ca 0.10 -0.17 0.04 0.00 0.00 0.00 0.00 51.96 51.94 1ce8 s ALA 766 Cb -0.12 0.34 -0.03 0.00 0.00 0.00 0.00 23.12 23.31 1ce8 s ALA 766 CO 0.02 -0.41 -0.11 0.42 0.00 0.00 0.00 175.76 175.68 1ce8 s ILE 767 N -2.74 3.35 -0.14 0.00 1.01 -0.77 -0.23 121.20 121.66 1ce8 s ILE 767 Ca -0.04 -0.82 -0.01 0.00 0.00 0.00 0.00 60.65 59.78 1ce8 s ILE 767 Cb -0.00 -2.41 0.04 0.00 0.01 0.00 0.00 42.46 40.10 1ce8 s ILE 767 CO -0.05 0.44 -0.02 0.00 0.00 0.00 0.00 174.94 175.32 1ce8 n ASP 769 N 5.00 2.16 0.00 0.00 5.75 -1.18 -1.41 116.55 126.87 1ce8 n ASP 769 Ca -0.10 -1.62 0.00 0.00 -0.01 0.00 0.00 54.79 53.06 1ce8 n ASP 769 Cb 0.48 0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.71 1ce8 n ASP 769 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ce8 n GLY 770 N 1.33 3.05 0.06 6.12 0.00 -1.26 -4.80 105.19 109.69 1ce8 n GLY 770 Ca 0.14 -0.44 -0.04 0.00 0.00 0.00 0.00 46.02 45.68 1ce8 n GLY 770 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1ce8 h GLU 771 N 0.00 0.00 0.00 1.61 5.08 -1.95 -3.49 114.58 115.82 1ce8 h GLU 771 Ca 0.00 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.12 1ce8 h GLU 771 Cb 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 1ce8 h GLU 771 CO 0.00 0.07 -0.19 0.00 -1.00 0.00 0.00 179.01 177.88 1ce8 n MET 772 N -4.67 0.95 -3.69 2.33 0.00 -1.26 -5.14 117.12 105.64 1ce8 n MET 772 Ca -0.06 -1.46 -0.16 0.00 0.00 0.00 0.00 57.70 56.03 1ce8 n MET 772 Cb 0.19 0.70 -0.15 0.00 0.00 0.00 0.00 33.22 33.95 1ce8 n MET 772 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 1ce8 s VAL 773 N -2.08 -0.21 -0.10 3.17 1.01 -1.26 -3.09 120.40 117.84 1ce8 s VAL 773 Ca 0.07 0.30 -0.12 0.00 0.00 0.00 0.00 61.98 62.23 1ce8 s VAL 773 Cb 0.00 -0.29 -0.05 0.00 0.00 0.00 0.00 36.38 36.04 1ce8 s VAL 773 CO 0.05 0.13 0.28 -0.22 0.00 0.00 0.00 175.10 175.34 1ce8 s LEU 774 N 1.99 4.36 -0.35 3.92 2.96 -0.93 -4.97 118.68 125.67 1ce8 s LEU 774 Ca -0.01 0.64 -0.14 0.00 -0.22 0.00 0.00 54.13 54.41 1ce8 s LEU 774 Cb -0.12 -2.35 -0.01 0.00 0.50 0.00 0.00 46.19 44.21 1ce8 s LEU 774 CO -0.06 0.26 0.27 -0.63 -1.32 0.00 0.00 176.35 174.88 1ce8 s ILE 775 N -0.47 5.26 0.09 6.68 -1.09 -1.26 -1.86 121.20 128.55 1ce8 s ILE 775 Ca 0.18 -0.19 -0.17 0.00 -2.23 0.00 0.00 60.65 58.24 1ce8 s ILE 775 Cb -0.14 -3.76 -0.08 0.00 -1.58 0.00 0.00 42.46 36.91 1ce8 s ILE 775 CO 0.07 -0.05 1.47 1.23 -1.23 0.00 0.00 174.94 176.42 1ce8 h GLY 776 N 8.56 0.62 0.00 6.18 0.00 -1.34 -3.41 103.07 113.68 1ce8 h GLY 776 Ca -0.31 -0.54 0.00 0.00 0.00 0.00 0.00 47.33 46.48 1ce8 h GLY 776 CO 0.66 0.49 0.00 0.61 0.00 0.00 0.00 176.54 178.30 1ce8 n GLY 777 N -0.08 1.36 3.14 4.60 0.00 -1.12 -4.77 105.19 108.30 1ce8 n GLY 777 Ca -0.03 -0.34 -0.33 0.00 0.00 0.00 0.00 46.02 45.31 1ce8 n GLY 777 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ce8 s ILE 778 N -2.00 2.38 -0.17 -0.61 1.01 -1.26 -1.53 121.20 119.02 1ce8 s ILE 778 Ca 0.00 -1.15 -0.03 0.00 0.00 0.00 0.00 60.65 59.46 1ce8 s ILE 778 Cb 0.00 -2.19 -0.02 0.00 0.01 0.00 0.00 42.46 40.26 1ce8 s ILE 778 CO 0.00 0.27 -0.05 -0.04 0.00 0.00 0.00 174.94 175.12 1ce8 s MET 779 N 1.25 3.56 -0.25 2.79 -1.94 0.16 -4.13 119.30 120.74 1ce8 s MET 779 Ca -0.00 -0.57 -0.08 0.00 -1.71 0.00 0.00 55.69 53.33 1ce8 s MET 779 Cb -0.16 -2.90 -0.03 0.00 2.01 0.00 0.00 34.83 33.75 1ce8 s MET 779 CO -0.08 0.13 0.09 -2.00 -0.01 0.00 0.00 175.02 173.15 1ce8 s GLU 780 N 0.63 3.67 0.44 2.03 2.12 -0.66 -0.32 118.70 126.62 1ce8 s GLU 780 Ca -0.03 -0.47 -0.23 0.00 0.36 0.00 0.00 54.97 54.60 1ce8 s GLU 780 Cb -0.15 -3.37 -0.08 0.00 0.26 0.00 0.00 34.13 30.79 1ce8 s GLU 780 CO 0.02 -0.20 1.14 -1.01 -0.54 0.00 0.00 175.26 174.67 1ce8 s HIS 781 N 1.63 2.99 -0.06 5.30 3.76 -0.60 -0.27 115.29 128.05 1ce8 s HIS 781 Ca 0.06 1.56 -0.11 0.00 -0.15 0.00 0.00 55.06 56.43 1ce8 s HIS 781 Cb -0.15 -3.32 -0.07 0.00 1.11 0.00 0.00 32.58 30.15 1ce8 s HIS 781 CO 0.05 -1.27 0.44 0.82 -0.85 0.00 0.00 174.74 173.93 1ce8 h ILE 782 N 2.00 0.16 -3.91 0.60 5.03 -1.56 -3.43 117.51 116.40 1ce8 h ILE 782 Ca -0.49 -0.86 -0.51 0.00 -0.12 0.00 0.00 64.86 62.88 1ce8 h ILE 782 Cb 1.24 0.28 0.04 0.00 -3.03 0.00 0.00 36.82 35.35 1ce8 h ILE 782 CO 0.61 0.05 0.51 -1.61 -0.68 0.00 0.00 178.15 177.02 1ce8 s GLU 783 N -2.67 4.20 0.96 2.37 8.01 -1.26 -4.59 118.70 125.72 1ce8 s GLU 783 Ca -0.06 1.85 -0.13 0.00 0.01 0.00 0.00 54.97 56.65 1ce8 s GLU 783 Cb 0.00 -2.80 0.17 0.00 -4.31 0.00 0.00 34.13 27.18 1ce8 s GLU 783 CO 0.20 -0.19 1.12 1.14 0.01 0.00 0.00 175.26 177.53 1ce8 s GLN 784 N -2.10 0.74 0.31 1.61 0.00 -1.26 -4.48 119.66 114.48 1ce8 s GLN 784 Ca 0.54 0.36 -0.29 0.00 -0.00 0.00 0.00 55.36 55.96 1ce8 s GLN 784 Cb -0.31 -1.79 -0.13 0.00 0.00 0.00 0.00 33.01 30.78 1ce8 s GLN 784 CO 0.40 -2.48 1.35 0.00 0.00 0.00 0.00 175.29 174.56 1ce8 n ALA 785 N -3.98 1.37 0.00 2.60 0.00 -0.76 -2.30 120.51 117.44 1ce8 n ALA 785 Ca 0.06 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.88 1ce8 n ALA 785 Cb 0.58 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.75 1ce8 n ALA 785 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ce8 n GLY 786 N 1.28 0.83 2.94 0.00 0.00 -1.26 -4.83 105.19 104.16 1ce8 n GLY 786 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 1ce8 n GLY 786 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ce8 s VAL 787 N -2.00 1.81 0.05 1.61 1.01 -0.97 -2.38 120.40 119.52 1ce8 s VAL 787 Ca 0.00 -1.85 -0.16 0.00 0.00 0.00 0.00 61.98 59.97 1ce8 s VAL 787 Cb 0.00 -2.24 -0.09 0.00 0.00 0.00 0.00 36.38 34.05 1ce8 s VAL 787 CO 0.00 -0.46 0.38 1.57 0.00 0.00 0.00 175.10 176.59 1ce8 n HIS 788 N 4.48 0.04 -0.24 5.22 -0.00 0.15 -4.61 115.22 120.27 1ce8 n HIS 788 Ca -0.02 0.49 0.05 0.00 0.46 0.00 0.00 57.72 58.69 1ce8 n HIS 788 Cb 0.42 -0.97 0.16 0.00 -0.12 0.00 0.00 29.99 29.48 1ce8 n HIS 788 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 1ce8 h SER 789 N 0.97 -0.14 0.00 0.26 4.64 -1.92 0.17 113.55 117.53 1ce8 h SER 789 Ca -0.19 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1ce8 h SER 789 Cb 0.69 0.25 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 1ce8 h SER 789 CO 0.29 -0.09 0.51 1.23 -0.87 0.00 0.00 176.83 177.90 1ce8 h GLY 790 N 0.19 0.00 0.00 -0.77 0.00 -1.98 0.20 103.07 100.71 1ce8 h GLY 790 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.73 1ce8 h GLY 790 CO -0.55 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.21 1ce8 n ASP 791 N -2.77 1.35 -4.91 0.19 8.00 0.54 -4.63 116.55 114.32 1ce8 n ASP 791 Ca -0.01 -1.62 -0.31 0.00 0.71 0.00 0.00 54.79 53.55 1ce8 n ASP 791 Cb 0.54 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.60 1ce8 n ASP 791 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1ce8 s SER 792 N -0.62 6.39 0.82 -2.24 0.01 0.69 -4.79 113.70 113.96 1ce8 s SER 792 Ca 0.00 0.35 -0.12 0.00 1.31 0.00 0.00 55.95 57.49 1ce8 s SER 792 Cb 0.00 -1.99 0.08 0.00 0.21 0.00 0.00 66.02 64.32 1ce8 s SER 792 CO 0.00 0.16 1.10 0.00 0.41 0.00 0.00 173.24 174.91 1ce8 s ALA 793 N -1.51 2.14 -0.01 1.44 0.00 -1.26 -4.69 121.76 117.86 1ce8 s ALA 793 Ca 0.35 -0.24 -0.18 0.00 0.00 0.00 0.00 51.96 51.89 1ce8 s ALA 793 Cb -0.13 -3.10 0.03 0.00 0.00 0.00 0.00 23.12 19.92 1ce8 s ALA 793 CO 0.26 -1.85 0.38 0.00 0.00 0.00 0.00 175.76 174.55 1ce8 s SER 795 N -1.43 3.10 -0.14 0.00 1.04 0.63 -0.36 113.70 116.54 1ce8 s SER 795 Ca -0.12 -0.50 -0.00 0.00 0.48 0.00 0.00 55.95 55.81 1ce8 s SER 795 Cb -0.04 -0.77 0.03 0.00 0.10 0.00 0.00 66.02 65.35 1ce8 s SER 795 CO 0.04 0.26 -0.07 -0.22 0.98 0.00 0.00 173.24 174.23 1ce8 s LEU 796 N -0.25 1.47 0.95 2.42 0.20 0.28 -1.65 118.68 122.10 1ce8 s LEU 796 Ca -0.01 -0.50 -0.11 0.00 0.69 0.00 0.00 54.13 54.20 1ce8 s LEU 796 Cb -0.13 -0.92 0.16 0.00 -0.43 0.00 0.00 46.19 44.87 1ce8 s LEU 796 CO 0.03 -0.14 1.10 -2.16 -0.29 0.00 0.00 176.35 174.89 1ce8 s PRO 797 N 1.64 0.78 0.22 0.98 0.04 -1.26 -1.10 135.00 136.29 1ce8 s PRO 797 Ca 0.03 1.17 -0.32 0.00 0.04 0.00 0.00 61.00 61.92 1ce8 s PRO 797 Cb -0.14 -1.73 -0.14 0.00 0.04 0.00 0.00 34.50 32.54 1ce8 s PRO 797 CO -0.08 -2.67 1.43 0.00 0.04 0.00 0.00 177.00 175.72 1ce8 n ALA 798 N -4.22 1.01 1.04 8.56 0.00 -1.25 -4.85 120.51 120.80 1ce8 n ALA 798 Ca 0.08 0.42 0.12 0.00 0.00 0.00 0.00 53.44 54.07 1ce8 n ALA 798 Cb 0.53 -2.27 0.29 0.00 0.00 0.00 0.00 19.45 18.01 1ce8 n ALA 798 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1ce8 n TYR 799 N 2.21 0.00 0.00 0.00 4.11 -1.26 -4.61 117.16 117.61 1ce8 n TYR 799 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 58.03 1ce8 n TYR 799 Cb 0.30 -0.25 0.00 0.00 -0.00 0.00 0.00 39.34 39.39 1ce8 n TYR 799 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.86 177.11 1ce8 n THR 800 N -1.39 0.00 -1.82 -3.48 -2.24 -1.26 -5.11 114.28 98.98 1ce8 n THR 800 Ca 0.07 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.49 1ce8 n THR 800 Cb 0.34 -0.01 0.05 0.00 -2.10 0.00 0.00 70.33 68.61 1ce8 n THR 800 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1ce8 s LEU 801 N -0.84 3.55 0.14 3.22 1.43 -1.26 -5.02 118.68 119.89 1ce8 s LEU 801 Ca 0.00 2.38 -0.20 0.00 -1.03 0.00 0.00 54.13 55.28 1ce8 s LEU 801 Cb 0.00 -4.60 -0.07 0.00 0.03 0.00 0.00 46.19 41.55 1ce8 s LEU 801 CO 0.00 -1.81 0.65 -0.94 0.23 0.00 0.00 176.35 174.48 1ce8 s SER 802 N -1.74 7.12 0.32 2.29 1.04 -1.26 -4.93 113.70 116.53 1ce8 s SER 802 Ca 0.77 1.37 0.05 0.00 0.48 0.00 0.00 55.95 58.62 1ce8 s SER 802 Cb -0.30 -2.40 0.70 0.00 0.10 0.00 0.00 66.02 64.12 1ce8 s SER 802 CO 0.37 0.18 1.85 -0.61 0.98 0.00 0.00 173.24 176.01 1ce8 h GLN 803 N 4.11 0.81 -0.25 4.02 5.75 -1.99 0.36 115.11 127.92 1ce8 h GLN 803 Ca -0.48 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 57.95 1ce8 h GLN 803 Cb 1.20 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 29.56 1ce8 h GLN 803 CO 0.65 0.53 0.10 1.49 -2.65 0.00 0.00 178.83 178.95 1ce8 h GLU 804 N 0.83 0.34 0.20 1.69 4.81 -1.98 -0.67 114.58 119.79 1ce8 h GLU 804 Ca 0.48 -0.03 -0.35 0.00 -0.13 0.00 0.00 59.36 59.33 1ce8 h GLU 804 Cb 0.64 -0.07 0.01 0.00 0.63 0.00 0.00 28.75 29.97 1ce8 h GLU 804 CO -0.25 0.28 -1.71 0.82 -0.73 0.00 0.00 179.01 177.43 1ce8 h ILE 805 N 0.34 1.00 -0.95 2.32 2.04 -1.38 -3.02 117.51 117.86 1ce8 h ILE 805 Ca 0.09 -2.55 0.10 0.00 1.00 0.00 0.00 64.86 63.50 1ce8 h ILE 805 Cb 0.07 2.81 -0.07 0.00 -0.74 0.00 0.00 36.82 38.89 1ce8 h ILE 805 CO -0.01 0.85 0.61 1.56 0.00 0.00 0.00 178.15 181.16 1ce8 h GLN 806 N 0.11 0.94 0.00 2.37 4.20 -1.00 2.27 115.11 124.00 1ce8 h GLN 806 Ca -0.33 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.31 1ce8 h GLN 806 Cb 2.11 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 29.68 1ce8 h GLN 806 CO 0.19 0.62 -0.08 -0.44 -0.67 0.00 0.00 178.83 178.45 1ce8 h ASP 807 N 0.97 0.00 -0.12 1.46 3.32 -1.17 1.32 116.42 122.20 1ce8 h ASP 807 Ca 0.45 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 57.28 1ce8 h ASP 807 Cb 0.41 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.97 1ce8 h ASP 807 CO -0.21 0.08 -0.75 0.58 -1.72 0.00 0.00 179.24 177.22 1ce8 h VAL 808 N 0.00 1.28 -0.34 -1.35 2.07 0.39 -1.83 116.25 116.47 1ce8 h VAL 808 Ca -0.00 -1.96 -0.16 0.00 0.82 0.00 0.00 66.70 65.40 1ce8 h VAL 808 Cb 0.17 1.95 -0.01 0.00 -1.52 0.00 0.00 31.29 31.89 1ce8 h VAL 808 CO 0.01 0.62 -0.40 0.24 0.02 0.00 0.00 177.57 178.06 1ce8 h MET 809 N 0.53 0.84 0.10 1.57 2.86 -0.58 0.30 114.93 120.55 1ce8 h MET 809 Ca -0.04 -0.45 0.02 0.00 -2.06 0.00 0.00 59.70 57.17 1ce8 h MET 809 Cb 1.38 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 33.01 1ce8 h MET 809 CO 0.15 1.09 -0.30 0.00 1.06 0.00 0.00 176.91 178.91 1ce8 h ARG 810 N 0.69 -0.49 -0.53 1.72 3.08 0.18 0.34 114.38 119.36 1ce8 h ARG 810 Ca 0.05 0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 1ce8 h ARG 810 Cb 0.98 0.11 -0.03 0.00 0.08 0.00 0.00 29.97 31.11 1ce8 h ARG 810 CO 0.09 -0.33 0.32 0.37 -1.07 0.00 0.00 179.97 179.35 1ce8 h GLN 811 N -0.51 0.71 -0.24 0.04 4.15 -1.01 -2.65 115.11 115.60 1ce8 h GLN 811 Ca 0.04 -0.06 -0.16 0.00 0.77 0.00 0.00 58.65 59.24 1ce8 h GLN 811 Cb 0.55 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.09 1ce8 h GLN 811 CO -0.19 0.50 -0.46 1.96 -1.93 0.00 0.00 178.83 178.71 1ce8 h GLN 812 N 0.73 0.74 0.11 1.69 4.20 0.32 -2.15 115.11 120.75 1ce8 h GLN 812 Ca 0.19 -0.47 -0.01 0.00 0.06 0.00 0.00 58.65 58.43 1ce8 h GLN 812 Cb -0.03 0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.81 1ce8 h GLN 812 CO -0.04 1.09 -0.06 0.28 -0.67 0.00 0.00 178.83 179.44 1ce8 h VAL 813 N 0.47 0.88 -0.62 -0.54 2.07 -0.77 0.26 116.25 118.01 1ce8 h VAL 813 Ca 0.01 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.66 1ce8 h VAL 813 Cb 1.06 0.88 -0.12 0.00 -1.52 0.00 0.00 31.29 31.60 1ce8 h VAL 813 CO 0.10 0.00 -0.15 -0.61 0.02 0.00 0.00 177.57 176.93 1ce8 h GLN 814 N -0.16 0.00 -0.36 1.57 4.15 -1.47 0.86 115.11 119.71 1ce8 h GLN 814 Ca -0.01 -0.00 0.07 0.00 0.77 0.00 0.00 58.65 59.47 1ce8 h GLN 814 Cb 0.12 -0.00 -0.06 0.00 0.21 0.00 0.00 27.48 27.75 1ce8 h GLN 814 CO 0.02 0.00 -0.00 0.87 -1.93 0.00 0.00 178.83 177.80 1ce8 h LYS 815 N 0.00 0.10 -0.39 1.69 6.56 -0.76 -2.57 116.57 121.20 1ce8 h LYS 815 Ca 0.30 -0.01 -0.09 0.00 -1.06 0.00 0.00 60.65 59.79 1ce8 h LYS 815 Cb 0.45 -0.02 -0.01 0.00 -0.57 0.00 0.00 32.23 32.08 1ce8 h LYS 815 CO -0.63 0.06 -0.10 -0.07 -2.06 0.00 0.00 179.45 176.65 1ce8 h LEU 816 N 0.10 0.77 -0.01 2.94 3.38 0.28 -2.81 115.31 119.96 1ce8 h LEU 816 Ca 0.18 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1ce8 h LEU 816 Cb 0.24 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1ce8 h LEU 816 CO -0.30 0.96 -0.04 0.00 0.09 0.00 0.00 178.44 179.15 1ce8 h ALA 817 N 0.83 -0.44 -0.88 1.53 0.00 0.94 -2.24 119.26 119.00 1ce8 h ALA 817 Ca 0.10 -0.00 0.15 0.00 0.00 0.00 0.00 54.91 55.16 1ce8 h ALA 817 Cb 0.63 0.62 -0.10 0.00 0.00 0.00 0.00 17.79 18.94 1ce8 h ALA 817 CO 0.04 -0.45 0.47 0.74 0.00 0.00 0.00 179.25 180.05 1ce8 h PHE 818 N -0.04 0.83 -0.81 0.00 0.04 -1.59 -2.16 116.94 113.22 1ce8 h PHE 818 Ca 0.00 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.79 1ce8 h PHE 818 Cb 0.04 -0.24 -0.04 0.00 2.20 0.00 0.00 35.95 37.92 1ce8 h PHE 818 CO -0.47 0.20 0.45 1.49 -0.60 0.00 0.00 178.31 179.37 1ce8 h GLU 819 N 0.66 1.12 0.00 1.51 4.57 -1.21 -2.99 114.58 118.24 1ce8 h GLU 819 Ca 0.49 -0.12 0.00 0.00 -1.18 0.00 0.00 59.36 58.54 1ce8 h GLU 819 Cb 0.69 -0.22 0.00 0.00 -0.16 0.00 0.00 28.75 29.06 1ce8 h GLU 819 CO -0.36 0.81 -1.11 1.28 -1.18 0.00 0.00 179.01 178.45 1ce8 n LEU 820 N -4.35 0.64 -1.59 1.64 4.77 -0.87 -4.99 117.00 112.25 1ce8 n LEU 820 Ca 0.08 0.16 -0.00 0.00 -0.03 0.00 0.00 56.01 56.22 1ce8 n LEU 820 Cb 0.09 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 1ce8 n LEU 820 CO 0.38 -0.08 0.01 0.00 -1.33 0.00 0.00 177.39 176.38 1ce8 n GLN 821 N -2.34 -0.09 -2.73 3.23 1.13 -0.86 -4.76 117.38 110.96 1ce8 n GLN 821 Ca 0.00 0.32 -0.43 0.00 -1.94 0.00 0.00 57.00 54.96 1ce8 n GLN 821 Cb 0.51 -1.73 -0.03 0.00 0.11 0.00 0.00 30.24 29.10 1ce8 n GLN 821 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1ce8 s VAL 822 N -3.01 4.62 -0.67 5.09 1.01 -0.94 -4.54 120.40 121.96 1ce8 s VAL 822 Ca 0.01 1.62 0.04 0.00 0.00 0.00 0.00 61.98 63.65 1ce8 s VAL 822 Cb -0.00 -4.32 0.16 0.00 0.00 0.00 0.00 36.38 32.22 1ce8 s VAL 822 CO 0.04 -0.37 0.45 -0.13 0.00 0.00 0.00 175.10 175.09 1ce8 s ARG 823 N 3.39 2.41 0.00 2.72 1.81 -1.17 -3.86 118.95 124.25 1ce8 s ARG 823 Ca 0.41 -3.11 0.00 0.00 -1.72 0.00 0.00 55.73 51.31 1ce8 s ARG 823 Cb -0.13 -3.46 0.00 0.00 -0.45 0.00 0.00 34.95 30.91 1ce8 s ARG 823 CO 0.13 -1.23 0.00 0.41 -0.68 0.00 0.00 175.30 173.93 1ce8 n GLY 824 N 2.38 0.55 3.79 -3.53 0.00 -0.50 -1.36 105.19 106.52 1ce8 n GLY 824 Ca 0.15 -1.89 -0.33 0.00 0.00 0.00 0.00 46.02 43.95 1ce8 n GLY 824 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ce8 s LEU 825 N 0.00 3.38 0.09 0.99 1.43 -1.26 -1.38 118.68 121.92 1ce8 s LEU 825 Ca 0.00 1.89 -0.26 0.00 -1.03 0.00 0.00 54.13 54.73 1ce8 s LEU 825 Cb 0.00 -4.54 0.07 0.00 0.03 0.00 0.00 46.19 41.75 1ce8 s LEU 825 CO 0.00 -1.48 0.63 0.00 0.23 0.00 0.00 176.35 175.74 1ce8 s MET 826 N -4.23 1.20 -0.01 1.70 0.23 0.68 -3.11 119.30 115.74 1ce8 s MET 826 Ca 0.65 -0.24 0.01 0.00 -1.03 0.00 0.00 55.69 55.08 1ce8 s MET 826 Cb -0.18 0.55 0.00 0.00 -1.53 0.00 0.00 34.83 33.68 1ce8 s MET 826 CO 0.42 -0.48 -0.04 1.21 -2.03 0.00 0.00 175.02 174.10 1ce8 s ASN 827 N -2.25 0.59 -0.04 -1.18 3.84 0.33 0.02 114.94 116.25 1ce8 s ASN 827 Ca -0.03 -0.08 0.03 0.00 0.21 0.00 0.00 52.86 52.99 1ce8 s ASN 827 Cb -0.01 -0.14 0.00 0.00 -0.55 0.00 0.00 41.25 40.55 1ce8 s ASN 827 CO -0.06 0.02 -0.13 -0.69 -2.79 0.00 0.00 177.10 173.45 1ce8 s VAL 828 N 0.20 1.09 -0.13 -5.21 1.01 0.15 0.45 120.40 117.96 1ce8 s VAL 828 Ca -0.02 -0.52 0.02 0.00 0.00 0.00 0.00 61.98 61.46 1ce8 s VAL 828 Cb -0.06 -0.95 0.00 0.00 0.00 0.00 0.00 36.38 35.38 1ce8 s VAL 828 CO -0.00 0.33 -0.19 -1.10 0.00 0.00 0.00 175.10 174.13 1ce8 s GLN 829 N 0.15 3.13 0.48 2.72 -0.21 -0.38 0.66 119.66 126.21 1ce8 s GLN 829 Ca -0.04 -0.81 0.03 0.00 0.02 0.00 0.00 55.36 54.56 1ce8 s GLN 829 Cb -0.10 -2.48 -0.03 0.00 1.00 0.00 0.00 33.01 31.40 1ce8 s GLN 829 CO 0.01 0.06 0.06 -0.06 -2.12 0.00 0.00 175.29 173.25 1ce8 s PHE 830 N 0.66 2.05 -0.07 0.91 0.08 -0.67 -1.19 117.98 119.75 1ce8 s PHE 830 Ca -0.10 -0.85 -0.03 0.00 0.12 0.00 0.00 56.93 56.08 1ce8 s PHE 830 Cb -0.16 -1.71 0.04 0.00 -0.57 0.00 0.00 43.02 40.62 1ce8 s PHE 830 CO 0.02 0.20 0.10 0.00 -0.10 0.00 0.00 175.22 175.44 1ce8 s ALA 831 N -2.81 0.11 -0.31 5.36 0.00 -0.04 -1.96 121.76 122.12 1ce8 s ALA 831 Ca 0.18 0.26 -0.14 0.00 0.00 0.00 0.00 51.96 52.27 1ce8 s ALA 831 Cb 0.03 -0.73 -0.03 0.00 0.00 0.00 0.00 23.12 22.39 1ce8 s ALA 831 CO 0.10 -0.59 0.29 0.08 0.00 0.00 0.00 175.76 175.64 1ce8 s VAL 832 N 2.21 5.23 -0.22 0.00 1.01 0.36 -1.81 120.40 127.18 1ce8 s VAL 832 Ca 0.04 0.12 -0.03 0.00 0.00 0.00 0.00 61.98 62.12 1ce8 s VAL 832 Cb -0.12 -3.70 0.07 0.00 0.00 0.00 0.00 36.38 32.62 1ce8 s VAL 832 CO -0.05 0.06 0.05 -0.75 0.00 0.00 0.00 175.10 174.42 1ce8 s LYS 833 N 1.90 0.63 -0.78 2.72 2.20 0.55 -1.42 119.74 125.55 1ce8 s LYS 833 Ca 0.10 -0.52 -0.04 0.00 -0.36 0.00 0.00 55.97 55.15 1ce8 s LYS 833 Cb -0.16 -2.04 -0.04 0.00 -1.51 0.00 0.00 37.83 34.07 1ce8 s LYS 833 CO 0.11 -0.71 0.68 0.09 -0.36 0.00 0.00 175.35 175.15 1ce8 n ASN 834 N 5.04 -4.95 -3.11 1.43 5.03 -1.26 -2.75 115.26 114.68 1ce8 n ASN 834 Ca -0.08 -0.51 -0.18 0.00 0.87 0.00 0.00 54.58 54.68 1ce8 n ASN 834 Cb 0.46 -3.92 -0.01 0.00 -1.02 0.00 0.00 39.78 35.29 1ce8 n ASN 834 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1ce8 n ASN 835 N -2.73 -3.02 -3.87 6.41 4.05 -1.26 -4.91 115.26 109.93 1ce8 n ASN 835 Ca -0.07 -0.17 -0.26 0.00 0.45 0.00 0.00 54.58 54.53 1ce8 n ASN 835 Cb 0.59 -2.56 -0.17 0.00 1.23 0.00 0.00 39.78 38.87 1ce8 n ASN 835 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 1ce8 s GLU 836 N -5.72 1.28 -0.18 1.20 0.41 -1.11 -5.10 118.70 109.48 1ce8 s GLU 836 Ca 0.28 -0.19 -0.21 0.00 -0.41 0.00 0.00 54.97 54.44 1ce8 s GLU 836 Cb -0.15 -1.48 -0.03 0.00 -1.78 0.00 0.00 34.13 30.70 1ce8 s GLU 836 CO 0.34 -0.30 0.65 0.08 -0.49 0.00 0.00 175.26 175.54 1ce8 s VAL 837 N 1.77 5.01 -0.08 2.63 1.01 -1.26 -0.33 120.40 129.15 1ce8 s VAL 837 Ca 0.05 1.23 0.04 0.00 0.00 0.00 0.00 61.98 63.30 1ce8 s VAL 837 Cb -0.13 -3.96 -0.01 0.00 0.00 0.00 0.00 36.38 32.28 1ce8 s VAL 837 CO -0.07 0.12 -0.21 -0.31 0.00 0.00 0.00 175.10 174.62 1ce8 s TYR 838 N 1.83 2.57 -0.25 5.22 1.51 -0.75 -4.53 117.35 122.95 1ce8 s TYR 838 Ca 0.30 -0.75 -0.27 0.00 -1.01 0.00 0.00 57.07 55.34 1ce8 s TYR 838 Cb -0.16 -1.68 0.00 0.00 -0.11 0.00 0.00 41.96 40.01 1ce8 s TYR 838 CO 0.11 -0.24 0.93 -1.17 -1.11 0.00 0.00 175.55 174.07 1ce8 s LEU 839 N 0.03 4.07 -0.15 -1.29 2.96 0.11 -0.86 118.68 123.55 1ce8 s LEU 839 Ca -0.08 1.13 -0.08 0.00 -0.22 0.00 0.00 54.13 54.87 1ce8 s LEU 839 Cb -0.15 -3.34 -0.24 0.00 0.50 0.00 0.00 46.19 42.96 1ce8 s LEU 839 CO 0.05 -0.62 0.25 -0.38 -1.32 0.00 0.00 176.35 174.33 1ce8 n ILE 840 N 5.38 1.71 -3.57 6.68 5.41 -0.33 -4.17 119.36 130.45 1ce8 n ILE 840 Ca 0.08 -0.55 -0.05 0.00 1.00 0.00 0.00 62.75 63.23 1ce8 n ILE 840 Cb 0.47 -1.74 -0.02 0.00 -0.71 0.00 0.00 39.64 37.64 1ce8 n ILE 840 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1ce8 s GLU 841 N -2.53 0.46 -0.09 0.38 -1.05 -1.03 -5.02 118.70 109.82 1ce8 s GLU 841 Ca -0.25 -0.18 0.00 0.00 -0.15 0.00 0.00 54.97 54.39 1ce8 s GLU 841 Cb 0.07 0.21 0.02 0.00 -0.44 0.00 0.00 34.13 33.99 1ce8 s GLU 841 CO 0.71 -0.20 -0.09 0.08 0.95 0.00 0.00 175.26 176.71 1ce8 s VAL 842 N -2.62 1.02 -0.35 1.83 1.01 -1.26 -1.25 120.40 118.77 1ce8 s VAL 842 Ca 0.08 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.74 1ce8 s VAL 842 Cb -0.01 -1.01 0.09 0.00 0.00 0.00 0.00 36.38 35.46 1ce8 s VAL 842 CO -0.06 0.35 0.08 0.20 0.00 0.00 0.00 175.10 175.68 1ce8 s ASN 843 N 1.35 4.93 0.00 3.32 0.01 0.17 -4.62 114.94 120.10 1ce8 s ASN 843 Ca -0.02 -1.94 0.00 0.00 -0.71 0.00 0.00 52.86 50.19 1ce8 s ASN 843 Cb -0.14 -1.70 0.00 0.00 0.41 0.00 0.00 41.25 39.82 1ce8 s ASN 843 CO -0.04 -0.41 1.29 -0.81 -1.51 0.00 0.00 177.10 175.63 1ce8 n PRO 844 N 4.43 0.66 -1.58 -0.60 -0.04 -1.26 0.12 135.00 136.73 1ce8 n PRO 844 Ca -0.02 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.43 1ce8 n PRO 844 Cb 0.42 -1.17 -0.00 0.00 -0.04 0.00 0.00 33.50 32.71 1ce8 n PRO 844 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1ce8 n ARG 845 N 1.64 0.04 -2.31 0.54 1.85 -1.18 -4.77 116.66 112.47 1ce8 n ARG 845 Ca 0.00 -0.15 -0.42 0.00 -1.00 0.00 0.00 57.85 56.28 1ce8 n ARG 845 Cb 0.33 0.15 -0.03 0.00 -1.05 0.00 0.00 32.46 31.86 1ce8 n ARG 845 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1ce8 s ALA 846 N -1.51 3.50 0.23 2.89 0.00 -1.02 -3.20 121.76 122.65 1ce8 s ALA 846 Ca 0.01 0.93 0.06 0.00 0.00 0.00 0.00 51.96 52.96 1ce8 s ALA 846 Cb -0.00 -3.51 -0.03 0.00 0.00 0.00 0.00 23.12 19.58 1ce8 s ALA 846 CO 0.01 -0.60 0.26 0.00 0.00 0.00 0.00 175.76 175.43 1ce8 s ALA 847 N 1.38 3.74 -2.00 0.00 0.00 -1.26 -4.84 121.76 118.78 1ce8 s ALA 847 Ca 0.61 -1.31 0.01 0.00 0.00 0.00 0.00 51.96 51.27 1ce8 s ALA 847 Cb -0.32 -1.50 0.06 0.00 0.00 0.00 0.00 23.12 21.37 1ce8 s ALA 847 CO 0.29 0.28 0.45 2.89 0.00 0.00 0.00 175.76 179.67 1ce8 n ARG 848 N -1.16 0.38 0.01 0.00 1.85 -1.26 -1.93 116.66 114.55 1ce8 n ARG 848 Ca -0.08 0.00 0.11 0.00 -1.00 0.00 0.00 57.85 56.88 1ce8 n ARG 848 Cb 0.57 -1.04 -0.14 0.00 -1.05 0.00 0.00 32.46 30.80 1ce8 n ARG 848 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1ce8 n THR 849 N -0.54 0.12 -0.22 8.89 -2.24 -1.26 -4.70 114.28 114.33 1ce8 n THR 849 Ca 0.01 -0.50 -0.06 0.00 -2.27 0.00 0.00 64.05 61.23 1ce8 n THR 849 Cb 0.00 -0.04 -0.01 0.00 -2.10 0.00 0.00 70.33 68.19 1ce8 n THR 849 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1ce8 h VAL 850 N 0.00 0.13 -0.11 2.28 2.07 -1.76 -1.12 116.25 117.74 1ce8 h VAL 850 Ca 0.00 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.56 1ce8 h VAL 850 Cb 0.99 0.13 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1ce8 h VAL 850 CO 0.00 0.00 -0.15 -0.65 0.02 0.00 0.00 177.57 176.79 1ce8 h PRO 851 N -0.17 -0.19 0.01 1.57 0.11 -1.84 2.91 132.00 134.39 1ce8 h PRO 851 Ca 0.22 0.01 0.03 0.00 0.11 0.00 0.00 66.00 66.37 1ce8 h PRO 851 Cb 0.56 0.04 -0.04 0.00 0.11 0.00 0.00 31.00 31.68 1ce8 h PRO 851 CO -0.70 -0.13 -0.20 0.35 -0.21 0.00 0.00 178.00 177.11 1ce8 h PHE 852 N -0.20 -0.52 -0.89 0.65 3.57 -1.76 0.62 116.94 118.40 1ce8 h PHE 852 Ca 0.09 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.66 1ce8 h PHE 852 Cb 0.33 0.23 -0.06 0.00 2.79 0.00 0.00 35.95 39.24 1ce8 h PHE 852 CO -0.26 -0.28 0.58 0.28 -2.23 0.00 0.00 178.31 176.40 1ce8 h VAL 853 N -0.32 1.10 -0.39 1.41 2.07 -0.69 0.53 116.25 119.96 1ce8 h VAL 853 Ca 0.06 -0.36 -0.10 0.00 0.82 0.00 0.00 66.70 67.12 1ce8 h VAL 853 Cb 0.39 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.10 1ce8 h VAL 853 CO -0.18 0.19 -0.16 0.28 0.02 0.00 0.00 177.57 177.72 1ce8 h SER 854 N 1.05 0.73 -0.16 0.57 0.02 0.79 -2.17 113.55 114.38 1ce8 h SER 854 Ca 0.37 -0.23 -0.15 0.00 -0.84 0.00 0.00 61.79 60.94 1ce8 h SER 854 Cb 0.13 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 1ce8 h SER 854 CO -0.13 0.89 -0.45 0.11 -1.14 0.00 0.00 176.83 176.11 1ce8 h LYS 855 N 0.65 0.72 -0.11 3.45 6.56 0.11 -0.24 116.57 127.71 1ce8 h LYS 855 Ca 0.10 -0.40 -0.02 0.00 -1.06 0.00 0.00 60.65 59.28 1ce8 h LYS 855 Cb 0.63 0.02 -0.00 0.00 -0.57 0.00 0.00 32.23 32.31 1ce8 h LYS 855 CO 0.04 1.02 -0.00 0.00 -2.06 0.00 0.00 179.45 178.45 1ce8 h ALA 856 N 0.92 0.14 0.00 3.86 0.00 0.21 -3.34 119.26 121.05 1ce8 h ALA 856 Ca 0.04 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1ce8 h ALA 856 Cb 1.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1ce8 h ALA 856 CO 0.10 -0.17 -0.71 1.79 0.00 0.00 0.00 179.25 180.26 1ce8 h THR 857 N -0.09 0.00 -0.02 0.00 1.35 -1.40 -3.46 112.91 109.30 1ce8 h THR 857 Ca 0.03 -0.64 -0.01 0.00 -0.55 0.00 0.00 66.41 65.24 1ce8 h THR 857 Cb 0.36 1.21 -0.00 0.00 -1.73 0.00 0.00 68.15 67.99 1ce8 h THR 857 CO 0.01 0.00 -0.01 0.61 -0.25 0.00 0.00 175.52 175.88 1ce8 n GLY 858 N 1.29 0.47 3.20 5.82 0.00 -0.11 -4.97 105.19 110.89 1ce8 n GLY 858 Ca 0.02 -0.23 -0.38 0.00 0.00 0.00 0.00 46.02 45.44 1ce8 n GLY 858 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ce8 s VAL 859 N -1.95 3.64 0.00 1.61 1.01 -1.17 -5.00 120.40 118.53 1ce8 s VAL 859 Ca 0.00 -1.57 -0.17 0.00 0.00 0.00 0.00 61.98 60.24 1ce8 s VAL 859 Cb 0.00 -3.26 -0.21 0.00 0.00 0.00 0.00 36.38 32.91 1ce8 s VAL 859 CO 0.00 -0.45 1.27 -0.81 0.00 0.00 0.00 175.10 175.12 1ce8 n PRO 860 N 4.75 0.00 -0.40 2.72 -0.04 -1.26 -4.42 135.00 136.34 1ce8 n PRO 860 Ca -0.08 -0.74 0.32 0.00 -0.04 0.00 0.00 63.50 62.95 1ce8 n PRO 860 Cb 0.43 -2.20 0.60 0.00 -0.04 0.00 0.00 33.50 32.28 1ce8 n PRO 860 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1ce8 h LEU 861 N 14.13 0.32 0.01 1.53 3.38 -1.90 -1.52 115.31 131.25 1ce8 h LEU 861 Ca 0.14 0.12 -0.17 0.00 0.09 0.00 0.00 57.88 58.06 1ce8 h LEU 861 Cb 0.41 0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.26 1ce8 h LEU 861 CO 1.53 -0.10 -0.68 0.00 0.09 0.00 0.00 178.44 179.28 1ce8 h ALA 862 N 1.62 0.07 -0.57 1.53 0.00 -1.93 -2.43 119.26 117.56 1ce8 h ALA 862 Ca 0.74 -0.60 0.10 0.00 0.00 0.00 0.00 54.91 55.15 1ce8 h ALA 862 Cb 2.18 0.04 -0.08 0.00 0.00 0.00 0.00 17.79 19.94 1ce8 h ALA 862 CO -0.39 0.40 0.15 0.87 0.00 0.00 0.00 179.25 180.28 1ce8 h LYS 863 N -0.05 0.29 0.91 0.00 1.57 -1.50 0.54 116.57 118.33 1ce8 h LYS 863 Ca -0.09 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.63 1ce8 h LYS 863 Cb 1.39 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 33.64 1ce8 h LYS 863 CO 0.13 0.19 -0.44 0.28 -0.57 0.00 0.00 179.45 179.05 1ce8 h VAL 864 N 0.30 0.06 0.00 0.50 2.07 -1.42 0.47 116.25 118.23 1ce8 h VAL 864 Ca 0.29 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.74 1ce8 h VAL 864 Cb 0.39 0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1ce8 h VAL 864 CO -0.34 0.00 -0.05 0.00 0.02 0.00 0.00 177.57 177.20 1ce8 h ALA 865 N -1.22 1.74 0.70 1.67 0.00 -1.27 0.70 119.26 121.58 1ce8 h ALA 865 Ca -0.12 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1ce8 h ALA 865 Cb 0.94 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.73 1ce8 h ALA 865 CO 0.20 0.06 -0.33 0.00 0.00 0.00 0.00 179.25 179.18 1ce8 h ALA 866 N 1.95 -0.94 -0.69 0.00 0.00 0.62 0.15 119.26 120.35 1ce8 h ALA 866 Ca -0.00 -0.22 0.19 0.00 0.00 0.00 0.00 54.91 54.88 1ce8 h ALA 866 Cb 0.09 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1ce8 h ALA 866 CO 0.01 -0.92 0.49 0.00 0.00 0.00 0.00 179.25 178.83 1ce8 h ARG 867 N -1.16 0.09 -0.15 0.00 3.08 0.16 -1.20 114.38 115.20 1ce8 h ARG 867 Ca -0.10 -0.01 -0.12 0.00 0.07 0.00 0.00 59.98 59.83 1ce8 h ARG 867 Cb 0.74 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.78 1ce8 h ARG 867 CO 0.16 0.06 -0.39 0.28 -1.07 0.00 0.00 179.97 179.01 1ce8 h VAL 868 N 0.09 1.35 -0.30 2.04 2.07 0.68 -1.04 116.25 121.15 1ce8 h VAL 868 Ca 0.33 -1.65 -0.03 0.00 0.82 0.00 0.00 66.70 66.17 1ce8 h VAL 868 Cb 1.19 2.00 -0.02 0.00 -1.52 0.00 0.00 31.29 32.95 1ce8 h VAL 868 CO -0.03 0.50 0.07 0.24 0.02 0.00 0.00 177.57 178.37 1ce8 h MET 869 N 0.17 0.43 0.00 1.57 2.86 0.53 -2.53 114.93 117.96 1ce8 h MET 869 Ca -0.00 -0.06 -0.19 0.00 -2.06 0.00 0.00 59.70 57.39 1ce8 h MET 869 Cb 1.00 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.56 1ce8 h MET 869 CO 0.08 0.40 -0.86 0.00 1.06 0.00 0.00 176.91 177.59 1ce8 h ALA 870 N 1.66 0.57 0.00 6.32 0.00 -1.48 -3.34 119.26 122.99 1ce8 h ALA 870 Ca 0.10 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.27 1ce8 h ALA 870 Cb 0.17 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1ce8 h ALA 870 CO -0.00 0.99 0.00 0.41 0.00 0.00 0.00 179.25 180.64 1ce8 n GLY 871 N 0.88 0.61 3.70 0.00 0.00 -0.95 -5.12 105.19 104.31 1ce8 n GLY 871 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1ce8 n GLY 871 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ce8 s LYS 872 N 0.00 4.47 0.49 1.61 2.20 -0.42 -4.98 119.74 123.11 1ce8 s LYS 872 Ca 0.00 1.27 -0.13 0.00 -0.36 0.00 0.00 55.97 56.75 1ce8 s LYS 872 Cb 0.00 -3.49 -0.07 0.00 -1.51 0.00 0.00 37.83 32.76 1ce8 s LYS 872 CO 0.00 -0.12 0.90 -1.54 -0.36 0.00 0.00 175.35 174.23 1ce8 s SER 873 N 1.01 6.51 0.42 1.43 1.04 -1.26 -3.28 113.70 119.56 1ce8 s SER 873 Ca 0.47 1.35 0.16 0.00 0.48 0.00 0.00 55.95 58.41 1ce8 s SER 873 Cb -0.19 -2.42 1.05 0.00 0.10 0.00 0.00 66.02 64.56 1ce8 s SER 873 CO 0.22 -0.56 1.88 -0.07 0.98 0.00 0.00 173.24 175.68 1ce8 h LEU 874 N 0.80 0.42 0.00 2.42 3.38 -1.94 0.33 115.31 120.73 1ce8 h LEU 874 Ca -0.47 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.54 1ce8 h LEU 874 Cb 1.19 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1ce8 h LEU 874 CO 0.62 0.19 -0.00 0.00 0.09 0.00 0.00 178.44 179.34 1ce8 h ALA 875 N 1.62 -0.00 0.00 1.53 0.00 -1.92 -1.14 119.26 119.35 1ce8 h ALA 875 Ca 0.43 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 1ce8 h ALA 875 Cb 1.02 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1ce8 h ALA 875 CO -0.16 -0.37 -0.20 0.93 0.00 0.00 0.00 179.25 179.45 1ce8 h GLU 876 N -0.26 0.00 0.00 0.00 5.08 -1.17 -1.46 114.58 116.77 1ce8 h GLU 876 Ca -0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1ce8 h GLU 876 Cb 0.26 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1ce8 h GLU 876 CO 0.00 0.20 -0.27 1.96 -1.00 0.00 0.00 179.01 179.90 1ce8 h GLN 877 N 0.00 0.00 -0.59 2.33 4.20 -0.46 -3.47 115.11 117.12 1ce8 h GLN 877 Ca -0.00 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.53 1ce8 h GLN 877 Cb 0.45 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.18 1ce8 h GLN 877 CO 0.03 0.27 -0.17 0.41 -0.67 0.00 0.00 178.83 178.69 1ce8 n GLY 878 N 0.99 0.80 2.97 3.46 0.00 -0.55 -4.92 105.19 107.94 1ce8 n GLY 878 Ca 0.02 -0.62 -0.31 0.00 0.00 0.00 0.00 46.02 45.11 1ce8 n GLY 878 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ce8 s VAL 879 N -2.34 3.17 -0.03 1.61 1.01 -0.49 -4.83 120.40 118.50 1ce8 s VAL 879 Ca 0.00 -3.88 0.01 0.00 0.00 0.00 0.00 61.98 58.12 1ce8 s VAL 879 Cb 0.00 -3.07 -0.03 0.00 0.00 0.00 0.00 36.38 33.28 1ce8 s VAL 879 CO 0.00 -0.96 -0.01 0.35 0.00 0.00 0.00 175.10 174.48 1ce8 n THR 880 N 2.43 0.18 -3.54 3.92 -2.24 -1.25 -4.47 114.28 109.30 1ce8 n THR 880 Ca 0.16 -0.09 -0.32 0.00 -2.27 0.00 0.00 64.05 61.52 1ce8 n THR 880 Cb 0.35 -0.78 -0.05 0.00 -2.10 0.00 0.00 70.33 67.75 1ce8 n THR 880 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1ce8 s LYS 881 N -2.06 3.73 -0.23 -0.78 -0.14 -1.26 -4.81 119.74 114.19 1ce8 s LYS 881 Ca -0.03 0.12 -0.23 0.00 -1.36 0.00 0.00 55.97 54.48 1ce8 s LYS 881 Cb 0.01 -2.79 -0.01 0.00 -1.68 0.00 0.00 37.83 33.35 1ce8 s LYS 881 CO 0.09 0.42 0.74 -2.00 -0.76 0.00 0.00 175.35 173.84 1ce8 s GLU 882 N -2.58 4.18 0.42 1.68 2.12 -1.26 -4.91 118.70 118.35 1ce8 s GLU 882 Ca 0.42 0.77 -0.23 0.00 0.36 0.00 0.00 54.97 56.29 1ce8 s GLU 882 Cb -0.12 -3.63 -0.09 0.00 0.26 0.00 0.00 34.13 30.55 1ce8 s GLU 882 CO 0.22 -0.42 1.07 0.08 -0.54 0.00 0.00 175.26 175.67 1ce8 s VAL 883 N 2.52 3.59 -0.34 3.70 1.01 -1.26 -5.04 120.40 124.58 1ce8 s VAL 883 Ca 0.31 1.18 0.00 0.00 0.00 0.00 0.00 61.98 63.48 1ce8 s VAL 883 Cb -0.16 -3.59 0.14 0.00 0.00 0.00 0.00 36.38 32.77 1ce8 s VAL 883 CO 0.09 -0.03 0.27 -0.63 0.00 0.00 0.00 175.10 174.79 1ce8 s ILE 884 N -1.67 -0.14 0.67 2.22 -1.09 -1.26 -4.94 121.20 114.98 1ce8 s ILE 884 Ca 0.60 -1.11 -0.17 0.00 -2.23 0.00 0.00 60.65 57.74 1ce8 s ILE 884 Cb -0.23 -0.93 -0.01 0.00 -1.58 0.00 0.00 42.46 39.72 1ce8 s ILE 884 CO 0.28 -0.73 1.08 -2.65 -1.23 0.00 0.00 174.94 171.69 1ce8 n PRO 885 N 4.52 0.79 0.24 2.79 -0.02 -1.26 -4.91 135.00 137.14 1ce8 n PRO 885 Ca 0.06 0.32 0.10 0.00 -2.02 0.00 0.00 63.50 61.96 1ce8 n PRO 885 Cb 0.42 -2.31 0.58 0.00 -0.02 0.00 0.00 33.50 32.17 1ce8 n PRO 885 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1ce8 h PRO 886 N 0.16 0.00 -5.84 0.52 0.11 -1.92 -3.46 132.00 121.57 1ce8 h PRO 886 Ca -0.49 0.00 -0.60 0.00 0.11 0.00 0.00 66.00 65.03 1ce8 h PRO 886 Cb 1.34 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.39 1ce8 h PRO 886 CO 0.50 0.20 -0.33 1.52 -0.21 0.00 0.00 178.00 179.68 1ce8 s TYR 887 N -4.06 1.66 -0.21 0.65 -0.85 -1.26 -4.99 117.35 108.28 1ce8 s TYR 887 Ca -0.02 -0.85 -0.09 0.00 -0.52 0.00 0.00 57.07 55.59 1ce8 s TYR 887 Cb 0.13 -1.88 -0.04 0.00 0.38 0.00 0.00 41.96 40.55 1ce8 s TYR 887 CO 0.63 -0.39 0.11 0.71 -1.52 0.00 0.00 175.55 175.09 1ce8 s TYR 888 N -2.78 3.27 -0.27 -3.49 2.02 0.34 -4.57 117.35 111.86 1ce8 s TYR 888 Ca 0.30 0.10 -0.04 0.00 -0.37 0.00 0.00 57.07 57.07 1ce8 s TYR 888 Cb -0.02 -2.17 0.02 0.00 -0.40 0.00 0.00 41.96 39.39 1ce8 s TYR 888 CO 0.19 0.08 0.01 -1.12 -1.57 0.00 0.00 175.55 173.14 1ce8 s SER 889 N 0.75 4.72 -0.04 2.29 0.01 -0.26 0.41 113.70 121.58 1ce8 s SER 889 Ca 0.06 -0.83 0.07 0.00 1.31 0.00 0.00 55.95 56.56 1ce8 s SER 889 Cb -0.13 -1.77 -0.02 0.00 0.21 0.00 0.00 66.02 64.32 1ce8 s SER 889 CO 0.02 -0.17 -0.25 -0.69 0.41 0.00 0.00 173.24 172.57 1ce8 s VAL 890 N 1.40 2.14 -0.15 3.43 1.01 0.12 0.10 120.40 128.45 1ce8 s VAL 890 Ca 0.01 -1.06 -0.04 0.00 0.00 0.00 0.00 61.98 60.89 1ce8 s VAL 890 Cb -0.17 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 1ce8 s VAL 890 CO -0.01 0.58 0.00 -0.75 0.00 0.00 0.00 175.10 174.92 1ce8 s LYS 891 N -0.41 3.64 0.14 2.72 2.20 0.51 0.13 119.74 128.67 1ce8 s LYS 891 Ca 0.04 -0.44 0.09 0.00 -0.36 0.00 0.00 55.97 55.29 1ce8 s LYS 891 Cb -0.12 -2.98 -0.04 0.00 -1.51 0.00 0.00 37.83 33.18 1ce8 s LYS 891 CO 0.01 0.34 -0.20 -2.00 -0.36 0.00 0.00 175.35 173.15 1ce8 s GLU 892 N 0.12 1.24 0.30 4.03 2.56 -0.59 -1.09 118.70 125.27 1ce8 s GLU 892 Ca 0.01 -1.33 0.08 0.00 0.00 0.00 0.00 54.97 53.73 1ce8 s GLU 892 Cb -0.13 -1.40 -0.03 0.00 2.00 0.00 0.00 34.13 34.57 1ce8 s GLU 892 CO 0.02 0.30 0.20 0.14 -0.56 0.00 0.00 175.26 175.36 1ce8 s VAL 893 N -1.69 3.72 -0.09 3.70 -7.23 -1.26 -0.67 120.40 116.88 1ce8 s VAL 893 Ca 0.13 -1.51 0.04 0.00 -1.81 0.00 0.00 61.98 58.83 1ce8 s VAL 893 Cb -0.07 -3.17 -0.01 0.00 0.56 0.00 0.00 36.38 33.68 1ce8 s VAL 893 CO 0.06 -0.26 -0.21 0.68 -0.31 0.00 0.00 175.10 175.06 1ce8 s VAL 894 N -2.28 2.39 0.03 1.32 -7.23 -0.37 -4.90 120.40 109.36 1ce8 s VAL 894 Ca 0.37 -0.93 0.06 0.00 -1.81 0.00 0.00 61.98 59.67 1ce8 s VAL 894 Cb -0.06 -1.92 -0.03 0.00 0.56 0.00 0.00 36.38 34.93 1ce8 s VAL 894 CO 0.24 0.56 -0.15 -0.76 -0.31 0.00 0.00 175.10 174.69 1ce8 s LEU 895 N 0.04 2.77 0.00 1.32 1.43 -1.26 -1.69 118.68 121.29 1ce8 s LEU 895 Ca -0.08 -0.34 0.03 0.00 -1.03 0.00 0.00 54.13 52.71 1ce8 s LEU 895 Cb -0.15 -1.61 0.18 0.00 0.03 0.00 0.00 46.19 44.64 1ce8 s LEU 895 CO 0.05 0.27 1.02 -0.81 0.23 0.00 0.00 176.35 177.11 1ce8 n PRO 896 N 1.58 0.90 -0.34 1.29 -0.04 -1.26 -4.41 135.00 132.71 1ce8 n PRO 896 Ca -0.16 0.00 0.17 0.00 -0.04 0.00 0.00 63.50 63.47 1ce8 n PRO 896 Cb 0.52 -1.05 0.37 0.00 -0.04 0.00 0.00 33.50 33.30 1ce8 n PRO 896 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1ce8 h PHE 897 N 0.00 0.96 0.00 0.54 0.04 -1.92 0.12 116.94 116.69 1ce8 h PHE 897 Ca 0.00 0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.81 1ce8 h PHE 897 Cb 0.00 -0.27 0.00 0.00 2.20 0.00 0.00 35.95 37.88 1ce8 h PHE 897 CO 0.00 0.05 0.00 0.27 -0.60 0.00 0.00 178.31 178.03 1ce8 n ASN 898 N -4.91 0.04 0.08 2.17 6.94 -1.26 -2.04 115.26 116.29 1ce8 n ASN 898 Ca 0.26 0.51 0.05 0.00 -0.02 0.00 0.00 54.58 55.39 1ce8 n ASN 898 Cb 0.72 -0.52 -0.02 0.00 -2.36 0.00 0.00 39.78 37.60 1ce8 n ASN 898 CO 0.00 0.00 0.00 0.11 -1.03 0.00 0.00 177.26 176.34 1ce8 h LYS 899 N 0.00 0.00 -2.15 -3.83 1.79 -1.10 -3.40 116.57 107.88 1ce8 h LYS 899 Ca 0.00 0.00 -0.58 0.00 -2.18 0.00 0.00 60.65 57.89 1ce8 h LYS 899 Cb 0.21 0.00 -0.40 0.00 -1.58 0.00 0.00 32.23 30.46 1ce8 h LYS 899 CO 0.00 0.18 -0.94 1.19 -1.08 0.00 0.00 179.45 178.79 1ce8 n PHE 900 N -2.85 0.68 0.25 -1.35 3.72 -0.86 -4.96 117.46 112.09 1ce8 n PHE 900 Ca -0.04 -3.71 0.17 0.00 -0.05 0.00 0.00 57.45 53.82 1ce8 n PHE 900 Cb 0.70 -0.33 0.79 0.00 -0.94 0.00 0.00 39.48 39.70 1ce8 n PHE 900 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1ce8 h PRO 901 N 4.33 0.00 0.00 -1.08 0.14 -1.77 0.36 132.00 133.98 1ce8 h PRO 901 Ca 0.13 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.27 1ce8 h PRO 901 Cb 0.83 0.00 0.00 0.00 0.14 0.00 0.00 31.00 31.97 1ce8 h PRO 901 CO 0.55 0.00 0.00 0.41 0.14 0.00 0.00 178.00 179.10 1ce8 n GLY 902 N -1.31 -1.16 3.91 1.56 0.00 -1.26 -4.73 105.19 102.19 1ce8 n GLY 902 Ca 0.01 -0.06 -0.27 0.00 0.00 0.00 0.00 46.02 45.69 1ce8 n GLY 902 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ce8 s VAL 903 N -3.00 4.99 -0.50 1.61 1.01 0.11 -4.53 120.40 120.09 1ce8 s VAL 903 Ca 0.09 0.03 -0.24 0.00 0.00 0.00 0.00 61.98 61.86 1ce8 s VAL 903 Cb 0.12 -3.79 0.03 0.00 0.00 0.00 0.00 36.38 32.74 1ce8 s VAL 903 CO 0.35 -0.52 0.90 -0.62 0.00 0.00 0.00 175.10 175.21 1ce8 s ASP 904 N -3.58 6.41 -0.87 3.32 2.15 -1.26 -4.94 116.67 117.91 1ce8 s ASP 904 Ca 0.45 -0.14 -0.17 0.00 0.43 0.00 0.00 52.55 53.12 1ce8 s ASP 904 Cb -0.10 -2.43 -0.11 0.00 -0.30 0.00 0.00 42.92 39.98 1ce8 s ASP 904 CO 0.35 -1.09 2.01 -0.81 -0.17 0.00 0.00 175.17 175.45 1ce8 n PRO 905 N 7.17 1.78 -4.44 4.34 -0.04 -1.26 -4.86 135.00 137.69 1ce8 n PRO 905 Ca 0.03 -1.78 -0.20 0.00 -0.04 0.00 0.00 63.50 61.51 1ce8 n PRO 905 Cb 0.48 -2.81 -0.15 0.00 -0.04 0.00 0.00 33.50 30.98 1ce8 n PRO 905 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1ce8 s LEU 906 N 0.91 1.98 0.49 1.53 2.96 -1.26 -4.97 118.68 120.32 1ce8 s LEU 906 Ca 0.52 -0.19 -0.22 0.00 -0.22 0.00 0.00 54.13 54.01 1ce8 s LEU 906 Cb 0.13 -0.54 -0.06 0.00 0.50 0.00 0.00 46.19 46.22 1ce8 s LEU 906 CO 0.06 0.12 1.21 -0.76 -1.32 0.00 0.00 176.35 175.66 1ce8 s LEU 907 N -0.17 3.94 0.00 -0.68 1.43 -1.26 -5.03 118.68 116.91 1ce8 s LEU 907 Ca 0.03 2.41 0.00 0.00 -1.03 0.00 0.00 54.13 55.54 1ce8 s LEU 907 Cb -0.05 -4.29 0.00 0.00 0.03 0.00 0.00 46.19 41.88 1ce8 s LEU 907 CO -0.00 -1.12 0.00 0.61 0.23 0.00 0.00 176.35 176.06 1ce8 n GLY 908 N 0.50 2.46 0.03 -3.19 0.00 -1.26 -4.97 105.19 98.76 1ce8 n GLY 908 Ca 0.09 -0.90 0.12 0.00 0.00 0.00 0.00 46.02 45.32 1ce8 n GLY 908 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ce8 n PRO 909 N 0.00 0.07 -4.37 1.61 -0.01 -1.00 0.30 135.00 131.60 1ce8 n PRO 909 Ca 0.00 0.15 -0.33 0.00 -0.01 0.00 0.00 63.50 63.31 1ce8 n PRO 909 Cb 0.00 -1.60 -0.09 0.00 -0.01 0.00 0.00 33.50 31.80 1ce8 n PRO 909 CO 0.00 0.00 0.00 -2.00 -0.01 0.00 0.00 175.50 173.49 1ce8 s GLU 910 N -3.05 2.78 0.05 -0.52 2.12 -1.26 -4.37 118.70 114.44 1ce8 s GLU 910 Ca 0.11 -0.58 -0.25 0.00 0.36 0.00 0.00 54.97 54.60 1ce8 s GLU 910 Cb 0.14 -2.66 -0.06 0.00 0.26 0.00 0.00 34.13 31.82 1ce8 s GLU 910 CO 0.46 0.64 0.78 1.41 -0.54 0.00 0.00 175.26 178.01 1ce8 s MET 911 N -1.32 4.51 0.00 4.30 -2.45 -1.26 -4.69 119.30 118.39 1ce8 s MET 911 Ca 0.17 1.10 0.00 0.00 -1.25 0.00 0.00 55.69 55.71 1ce8 s MET 911 Cb -0.11 -3.36 0.00 0.00 1.25 0.00 0.00 34.83 32.60 1ce8 s MET 911 CO 0.07 0.28 0.04 0.54 1.05 0.00 0.00 175.02 177.01 1ce8 n ARG 912 N 2.78 2.71 -2.17 4.11 3.00 -1.26 -4.91 116.66 120.92 1ce8 n ARG 912 Ca -0.02 -0.04 -0.35 0.00 -0.01 0.00 0.00 57.85 57.42 1ce8 n ARG 912 Cb 0.50 -0.33 0.01 0.00 0.00 0.00 0.00 32.46 32.64 1ce8 n ARG 912 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1ce8 s SER 913 N -0.40 5.54 -0.19 0.55 1.04 -1.26 -4.32 113.70 114.65 1ce8 s SER 913 Ca 0.00 2.23 0.07 0.00 0.48 0.00 0.00 55.95 58.73 1ce8 s SER 913 Cb 0.00 -2.58 -0.16 0.00 0.10 0.00 0.00 66.02 63.37 1ce8 s SER 913 CO 0.00 -1.35 -0.09 0.35 0.98 0.00 0.00 173.24 173.13 1ce8 n THR 914 N -1.43 1.19 -3.81 2.02 -2.24 -0.68 -4.45 114.28 104.88 1ce8 n THR 914 Ca 0.12 -0.56 -0.02 0.00 -2.27 0.00 0.00 64.05 61.32 1ce8 n THR 914 Cb 0.51 -0.99 -0.01 0.00 -2.10 0.00 0.00 70.33 67.74 1ce8 n THR 914 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ce8 n GLY 915 N 2.29 3.41 3.26 3.38 0.00 -0.69 -4.70 105.19 112.14 1ce8 n GLY 915 Ca -0.34 -1.53 -0.11 0.00 0.00 0.00 0.00 46.02 44.04 1ce8 n GLY 915 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ce8 s GLU 916 N -2.13 0.86 0.32 1.61 -1.05 -1.26 -1.24 118.70 115.82 1ce8 s GLU 916 Ca 0.04 -0.57 0.08 0.00 -0.15 0.00 0.00 54.97 54.37 1ce8 s GLU 916 Cb 0.00 0.37 -0.06 0.00 -0.44 0.00 0.00 34.13 34.00 1ce8 s GLU 916 CO 0.03 -0.29 -0.06 0.14 0.95 0.00 0.00 175.26 176.03 1ce8 s VAL 917 N -2.86 1.90 -0.01 1.83 -7.23 0.16 -4.24 120.40 109.95 1ce8 s VAL 917 Ca -0.03 -2.15 0.03 0.00 -1.81 0.00 0.00 61.98 58.03 1ce8 s VAL 917 Cb 0.00 -2.58 -0.01 0.00 0.56 0.00 0.00 36.38 34.35 1ce8 s VAL 917 CO -0.05 -0.23 -0.11 -0.32 -0.31 0.00 0.00 175.10 174.08 1ce8 s MET 918 N -3.68 0.91 -0.06 4.82 0.00 -0.65 -1.54 119.30 119.09 1ce8 s MET 918 Ca 0.31 -0.39 0.06 0.00 0.00 0.00 0.00 55.69 55.67 1ce8 s MET 918 Cb 0.04 -0.87 -0.01 0.00 0.00 0.00 0.00 34.83 33.99 1ce8 s MET 918 CO 0.14 0.23 -0.24 0.20 0.00 0.00 0.00 175.02 175.35 1ce8 s GLY 919 N -0.23 1.27 -0.15 2.11 0.00 0.34 -4.48 107.32 106.18 1ce8 s GLY 919 Ca 0.04 -1.01 0.02 0.00 0.00 0.00 0.00 44.72 43.77 1ce8 s GLY 919 CO -0.00 -0.58 -0.19 0.14 0.00 0.00 0.00 173.10 172.46 1ce8 s VAL 920 N -0.08 1.91 0.11 1.40 1.01 -1.26 0.15 120.40 123.66 1ce8 s VAL 920 Ca -0.06 -0.87 -0.06 0.00 0.00 0.00 0.00 61.98 60.99 1ce8 s VAL 920 Cb -0.14 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.50 1ce8 s VAL 920 CO 0.04 0.52 0.16 -0.83 0.00 0.00 0.00 175.10 174.99 1ce8 s GLY 921 N 1.12 0.42 0.30 4.51 0.00 0.17 -4.47 107.32 109.37 1ce8 s GLY 921 Ca -0.01 -0.95 0.03 0.00 0.00 0.00 0.00 44.72 43.80 1ce8 s GLY 921 CO -0.07 -1.00 1.78 3.21 0.00 0.00 0.00 173.10 177.02 1ce8 h ARG 922 N 2.78 0.51 -5.81 2.90 3.08 -1.93 0.99 114.38 116.90 1ce8 h ARG 922 Ca -0.33 -0.16 -0.51 0.00 0.07 0.00 0.00 59.98 59.05 1ce8 h ARG 922 Cb 1.20 -0.05 -0.14 0.00 0.08 0.00 0.00 29.97 31.05 1ce8 h ARG 922 CO 0.56 0.65 -0.75 0.95 -1.07 0.00 0.00 179.97 180.31 1ce8 s THR 923 N -4.69 2.00 0.22 2.04 -4.23 -1.26 -4.48 115.64 105.23 1ce8 s THR 923 Ca -0.07 -2.26 -0.07 0.00 -1.18 0.00 0.00 61.69 58.11 1ce8 s THR 923 Cb 0.14 -2.12 0.18 0.00 1.34 0.00 0.00 72.50 72.04 1ce8 s THR 923 CO 0.78 -0.51 1.75 0.15 -0.54 0.00 0.00 174.62 176.25 1ce8 h PHE 924 N 2.52 0.49 -0.43 3.99 3.57 -1.93 0.31 116.94 125.45 1ce8 h PHE 924 Ca -0.39 0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.20 1ce8 h PHE 924 Cb 1.23 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.83 1ce8 h PHE 924 CO 0.75 0.12 0.29 0.00 -2.23 0.00 0.00 178.31 177.23 1ce8 h ALA 925 N 1.46 1.95 0.08 2.41 0.00 -1.95 -0.02 119.26 123.19 1ce8 h ALA 925 Ca 0.35 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.24 1ce8 h ALA 925 Cb 0.46 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1ce8 h ALA 925 CO -0.33 -0.03 -0.04 1.49 0.00 0.00 0.00 179.25 180.35 1ce8 h GLU 926 N 0.35 -0.10 -0.29 0.00 4.81 -0.79 -2.14 114.58 116.42 1ce8 h GLU 926 Ca 0.19 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.49 1ce8 h GLU 926 Cb 0.29 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.63 1ce8 h GLU 926 CO -0.04 0.39 -0.14 0.00 -0.73 0.00 0.00 179.01 178.48 1ce8 h ALA 927 N 0.21 0.09 -0.97 2.92 0.00 -0.74 -0.35 119.26 120.41 1ce8 h ALA 927 Ca -0.01 0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1ce8 h ALA 927 Cb 0.53 0.34 -0.06 0.00 0.00 0.00 0.00 17.79 18.59 1ce8 h ALA 927 CO 0.02 -0.54 0.63 0.35 0.00 0.00 0.00 179.25 179.71 1ce8 h PHE 928 N -0.10 1.17 -0.12 0.00 3.57 -1.07 0.15 116.94 120.55 1ce8 h PHE 928 Ca 0.15 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.55 1ce8 h PHE 928 Cb 0.33 -0.39 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 1ce8 h PHE 928 CO -0.33 0.63 -0.49 0.00 -2.23 0.00 0.00 178.31 175.89 1ce8 h ALA 929 N 1.46 0.96 -0.09 2.41 0.00 -0.67 0.22 119.26 123.54 1ce8 h ALA 929 Ca 0.41 -0.47 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1ce8 h ALA 929 Cb 0.11 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1ce8 h ALA 929 CO -0.15 0.65 -0.00 0.87 0.00 0.00 0.00 179.25 180.62 1ce8 h LYS 930 N 0.24 0.17 -0.33 0.00 1.57 0.64 -1.09 116.57 117.77 1ce8 h LYS 930 Ca 0.01 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 1ce8 h LYS 930 Cb 0.95 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.23 1ce8 h LYS 930 CO 0.08 0.43 0.13 0.00 -0.57 0.00 0.00 179.45 179.52 1ce8 h ALA 931 N 0.73 1.62 -0.14 3.86 0.00 -0.63 0.53 119.26 125.23 1ce8 h ALA 931 Ca 0.03 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 1ce8 h ALA 931 Cb 0.35 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1ce8 h ALA 931 CO 0.01 0.30 -0.36 0.37 0.00 0.00 0.00 179.25 179.56 1ce8 h GLN 932 N 0.46 0.49 -0.45 0.00 4.15 -0.78 -1.62 115.11 117.36 1ce8 h GLN 932 Ca 0.11 -0.34 -0.13 0.00 0.77 0.00 0.00 58.65 59.06 1ce8 h GLN 932 Cb 0.09 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.82 1ce8 h GLN 932 CO -0.01 0.96 -0.23 1.25 -1.93 0.00 0.00 178.83 178.86 1ce8 h LEU 933 N 0.11 0.96 -1.54 -2.39 5.85 -0.98 -2.73 115.31 114.59 1ce8 h LEU 933 Ca -0.01 -0.37 -0.05 0.00 0.84 0.00 0.00 57.88 58.30 1ce8 h LEU 933 Cb 0.97 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 1ce8 h LEU 933 CO 0.08 1.14 -0.24 1.23 -0.34 0.00 0.00 178.44 180.31 1ce8 h GLY 934 N 0.90 0.00 -0.44 3.75 0.00 -0.86 -2.46 103.07 103.95 1ce8 h GLY 934 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 1ce8 h GLY 934 CO 0.07 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.47 1ce8 n SER 935 N -4.21 0.58 -0.39 0.19 3.41 -0.61 -4.72 113.62 107.87 1ce8 n SER 935 Ca -0.02 -2.02 -0.05 0.00 -0.26 0.00 0.00 58.87 56.52 1ce8 n SER 935 Cb 0.29 -0.13 -0.02 0.00 -0.26 0.00 0.00 64.21 64.09 1ce8 n SER 935 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1ce8 n ASN 936 N -0.23 -3.48 -4.77 4.04 4.05 -0.93 -4.89 115.26 109.06 1ce8 n ASN 936 Ca 0.02 0.11 -0.39 0.00 0.45 0.00 0.00 54.58 54.78 1ce8 n ASN 936 Cb 0.11 -1.51 -0.01 0.00 1.23 0.00 0.00 39.78 39.60 1ce8 n ASN 936 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 177.26 173.66 1ce8 s SER 937 N -2.94 6.41 0.00 1.20 0.15 -1.05 -4.93 113.70 112.54 1ce8 s SER 937 Ca 0.00 2.52 0.20 0.00 0.70 0.00 0.00 55.95 59.38 1ce8 s SER 937 Cb 0.00 -2.63 0.53 0.00 -1.71 0.00 0.00 66.02 62.21 1ce8 s SER 937 CO 0.00 -0.77 1.44 0.35 1.20 0.00 0.00 173.24 175.46 1ce8 n THR 938 N 0.12 0.57 -1.66 6.45 -2.24 -1.26 -4.82 114.28 111.44 1ce8 n THR 938 Ca 0.04 -0.68 -0.49 0.00 -2.27 0.00 0.00 64.05 60.65 1ce8 n THR 938 Cb 0.45 0.60 -0.05 0.00 -2.10 0.00 0.00 70.33 69.23 1ce8 n THR 938 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 1ce8 n MET 939 N 1.14 1.85 -3.52 -0.78 0.00 -1.26 -4.44 117.12 110.11 1ce8 n MET 939 Ca 0.19 0.67 -0.19 0.00 0.00 0.00 0.00 57.70 58.37 1ce8 n MET 939 Cb 0.50 -2.42 -0.01 0.00 0.00 0.00 0.00 33.22 31.29 1ce8 n MET 939 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 1ce8 s LYS 940 N 1.70 2.96 0.00 2.12 -0.14 -1.26 -5.04 119.74 120.09 1ce8 s LYS 940 Ca 0.85 -1.13 0.24 0.00 -1.36 0.00 0.00 55.97 54.57 1ce8 s LYS 940 Cb -0.77 -2.71 0.27 0.00 -1.68 0.00 0.00 37.83 32.94 1ce8 s LYS 940 CO 0.45 0.03 1.29 1.63 -0.76 0.00 0.00 175.35 177.99 1ce8 n LYS 941 N -1.59 1.95 -4.34 1.68 5.02 -1.26 -4.97 118.16 114.66 1ce8 n LYS 941 Ca 0.00 -1.56 -0.21 0.00 -2.02 0.00 0.00 58.31 54.52 1ce8 n LYS 941 Cb 0.59 -1.47 -0.08 0.00 -0.02 0.00 0.00 35.03 34.05 1ce8 n LYS 941 CO 0.00 0.00 0.00 -3.38 -0.52 0.00 0.00 177.40 173.50 1ce8 s HIS 942 N -2.12 1.77 0.00 2.13 -3.43 -1.26 -4.86 115.29 107.52 1ce8 s HIS 942 Ca 0.27 -1.60 0.00 0.00 -0.80 0.00 0.00 55.06 52.93 1ce8 s HIS 942 Cb 0.20 -0.81 0.00 0.00 -1.43 0.00 0.00 32.58 30.54 1ce8 s HIS 942 CO 0.37 -0.76 0.00 0.41 -2.00 0.00 0.00 174.74 172.76 1ce8 n GLY 943 N -0.70 -0.58 3.63 -1.38 0.00 -1.26 -4.78 105.19 100.13 1ce8 n GLY 943 Ca 0.05 -1.73 -0.34 0.00 0.00 0.00 0.00 46.02 43.99 1ce8 n GLY 943 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ce8 s ARG 944 N 0.00 3.97 0.10 1.61 3.52 -1.26 -0.65 118.95 126.24 1ce8 s ARG 944 Ca 0.00 -0.35 0.03 0.00 -0.13 0.00 0.00 55.73 55.28 1ce8 s ARG 944 Cb 0.00 -3.20 -0.04 0.00 -1.56 0.00 0.00 34.95 30.15 1ce8 s ARG 944 CO 0.00 0.28 0.13 0.00 -0.81 0.00 0.00 175.30 174.90 1ce8 s ALA 945 N 0.35 3.67 -0.17 6.12 0.00 -0.52 -1.76 121.76 129.45 1ce8 s ALA 945 Ca 0.03 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 50.95 1ce8 s ALA 945 Cb -0.12 -1.51 0.01 0.00 0.00 0.00 0.00 23.12 21.49 1ce8 s ALA 945 CO 0.00 0.68 -0.16 -1.17 0.00 0.00 0.00 175.76 175.11 1ce8 s LEU 946 N -2.67 2.35 -0.24 0.00 2.96 0.74 -1.85 118.68 119.98 1ce8 s LEU 946 Ca 0.31 -0.54 -0.04 0.00 -0.22 0.00 0.00 54.13 53.64 1ce8 s LEU 946 Cb -0.12 -1.54 0.00 0.00 0.50 0.00 0.00 46.19 45.03 1ce8 s LEU 946 CO 0.24 0.04 -0.02 -0.76 -1.32 0.00 0.00 176.35 174.53 1ce8 s LEU 947 N 1.08 3.12 -0.38 -0.68 1.02 0.08 -0.07 118.68 122.85 1ce8 s LEU 947 Ca -0.00 -0.53 0.02 0.00 0.02 0.00 0.00 54.13 53.63 1ce8 s LEU 947 Cb -0.14 -1.75 0.15 0.00 0.02 0.00 0.00 46.19 44.47 1ce8 s LEU 947 CO -0.05 -0.07 0.30 -0.55 0.02 0.00 0.00 176.35 175.99 1ce8 s SER 948 N 1.46 2.02 0.31 2.29 0.15 -0.65 -2.58 113.70 116.69 1ce8 s SER 948 Ca 0.04 -2.39 0.09 0.00 0.70 0.00 0.00 55.95 54.39 1ce8 s SER 948 Cb -0.15 -0.19 -0.05 0.00 -1.71 0.00 0.00 66.02 63.92 1ce8 s SER 948 CO -0.02 -0.25 0.03 0.68 1.20 0.00 0.00 173.24 174.88 1ce8 s VAL 949 N 0.77 3.04 0.74 4.45 -7.23 -1.26 -1.19 120.40 119.71 1ce8 s VAL 949 Ca 0.23 -1.90 -0.11 0.00 -1.81 0.00 0.00 61.98 58.39 1ce8 s VAL 949 Cb -0.12 -2.83 0.03 0.00 0.56 0.00 0.00 36.38 34.02 1ce8 s VAL 949 CO -0.07 -0.27 1.07 0.00 -0.31 0.00 0.00 175.10 175.52 1ce8 s ARG 950 N -3.72 2.57 0.17 4.82 1.04 -1.03 -4.81 118.95 117.98 1ce8 s ARG 950 Ca 0.34 0.90 -0.28 0.00 -1.04 0.00 0.00 55.73 55.65 1ce8 s ARG 950 Cb -0.03 -1.95 -0.00 0.00 -2.04 0.00 0.00 34.95 30.92 1ce8 s ARG 950 CO 0.20 -1.35 1.55 1.49 -0.04 0.00 0.00 175.30 177.15 1ce8 h GLU 951 N -0.90 -0.12 0.00 3.89 4.57 -1.98 0.18 114.58 120.22 1ce8 h GLU 951 Ca -0.45 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.74 1ce8 h GLU 951 Cb 1.23 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.85 1ce8 h GLU 951 CO 0.57 -0.08 0.00 0.41 -1.18 0.00 0.00 179.01 178.73 1ce8 n GLY 952 N -1.35 -0.41 0.13 1.92 0.00 -1.26 -1.80 105.19 102.42 1ce8 n GLY 952 Ca 0.02 -0.05 0.05 0.00 0.00 0.00 0.00 46.02 46.05 1ce8 n GLY 952 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ce8 n ASP 953 N -1.14 0.89 -0.32 1.61 8.00 0.60 -4.66 116.55 121.53 1ce8 n ASP 953 Ca 0.05 -0.95 0.06 0.00 0.71 0.00 0.00 54.79 54.67 1ce8 n ASP 953 Cb 0.05 0.71 0.26 0.00 -0.02 0.00 0.00 41.12 42.12 1ce8 n ASP 953 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1ce8 h LYS 954 N 0.64 0.94 0.37 -1.24 1.57 -0.94 -0.41 116.57 117.50 1ce8 h LYS 954 Ca 0.00 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 1ce8 h LYS 954 Cb 0.30 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1ce8 h LYS 954 CO 0.00 0.62 -0.18 0.93 -0.57 0.00 0.00 179.45 180.25 1ce8 h GLU 955 N 0.97 -0.48 -0.85 3.15 5.08 -1.83 -3.31 114.58 117.31 1ce8 h GLU 955 Ca 0.44 0.03 0.13 0.00 -1.00 0.00 0.00 59.36 58.96 1ce8 h GLU 955 Cb 0.38 0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.68 1ce8 h GLU 955 CO -0.20 -0.32 0.55 0.00 -1.00 0.00 0.00 179.01 178.05 1ce8 h ARG 956 N -0.59 0.67 -0.66 2.33 3.08 -1.85 -2.84 114.38 114.52 1ce8 h ARG 956 Ca -0.05 -0.04 0.19 0.00 0.07 0.00 0.00 59.98 60.15 1ce8 h ARG 956 Cb 0.38 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 1ce8 h ARG 956 CO 0.08 0.44 0.68 -0.24 -1.07 0.00 0.00 179.97 179.86 1ce8 h VAL 957 N 0.69 0.29 0.22 2.04 3.04 -1.16 -1.74 116.25 119.63 1ce8 h VAL 957 Ca 0.42 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 66.10 1ce8 h VAL 957 Cb 0.64 0.47 -0.00 0.00 -2.01 0.00 0.00 31.29 30.38 1ce8 h VAL 957 CO -0.18 0.00 -0.14 0.58 -1.01 0.00 0.00 177.57 176.82 1ce8 h VAL 958 N 0.00 0.70 -0.40 1.51 2.07 -1.66 0.89 116.25 119.36 1ce8 h VAL 958 Ca 0.31 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.87 1ce8 h VAL 958 Cb 1.67 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 32.10 1ce8 h VAL 958 CO -0.00 0.00 0.17 -0.78 0.02 0.00 0.00 177.57 176.97 1ce8 h ASP 959 N -0.35 0.22 -0.39 0.57 3.58 -1.55 0.12 116.42 118.62 1ce8 h ASP 959 Ca -0.02 0.03 0.07 0.00 0.42 0.00 0.00 57.03 57.53 1ce8 h ASP 959 Cb 0.30 -0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.29 1ce8 h ASP 959 CO 0.02 0.16 0.01 0.25 -2.88 0.00 0.00 179.24 176.80 1ce8 h LEU 960 N 0.35 -0.13 -1.08 2.28 5.85 -1.44 0.15 115.31 121.28 1ce8 h LEU 960 Ca 0.18 0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.99 1ce8 h LEU 960 Cb 0.12 0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 1ce8 h LEU 960 CO -0.15 -0.03 0.62 0.00 -0.34 0.00 0.00 178.44 178.54 1ce8 h ALA 961 N 1.33 1.34 -0.63 1.25 0.00 -0.25 -0.86 119.26 121.44 1ce8 h ALA 961 Ca 0.19 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1ce8 h ALA 961 Cb 0.26 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1ce8 h ALA 961 CO -0.31 0.61 0.40 0.00 0.00 0.00 0.00 179.25 179.95 1ce8 h ALA 962 N 1.42 0.81 -0.70 0.00 0.00 0.70 -1.53 119.26 119.95 1ce8 h ALA 962 Ca 0.35 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1ce8 h ALA 962 Cb -0.13 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.37 1ce8 h ALA 962 CO -0.08 0.26 0.40 0.87 0.00 0.00 0.00 179.25 180.70 1ce8 h LYS 963 N 0.86 0.97 0.00 0.00 1.57 0.44 -1.98 116.57 118.43 1ce8 h LYS 963 Ca 0.23 -0.11 -0.05 0.00 -1.87 0.00 0.00 60.65 58.85 1ce8 h LYS 963 Cb -0.06 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.05 1ce8 h LYS 963 CO -0.05 0.72 -0.26 -0.07 -0.57 0.00 0.00 179.45 179.22 1ce8 h LEU 964 N 0.96 0.00 -0.17 2.94 3.38 -0.74 -2.76 115.31 118.93 1ce8 h LEU 964 Ca 0.25 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 58.02 1ce8 h LEU 964 Cb 0.02 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.77 1ce8 h LEU 964 CO -0.04 0.26 -0.69 -0.07 0.09 0.00 0.00 178.44 177.99 1ce8 h LEU 965 N 0.00 0.89 -2.09 1.67 3.38 -0.88 0.83 115.31 119.11 1ce8 h LEU 965 Ca -0.00 -0.61 -0.01 0.00 0.09 0.00 0.00 57.88 57.34 1ce8 h LEU 965 Cb 0.77 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 1ce8 h LEU 965 CO 0.03 1.36 -0.06 0.50 0.09 0.00 0.00 178.44 180.36 1ce8 h LYS 966 N 0.48 0.00 -0.01 1.13 3.64 -1.20 -1.38 116.57 119.23 1ce8 h LYS 966 Ca -0.04 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1ce8 h LYS 966 Cb 1.32 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 1ce8 h LYS 966 CO 0.14 0.06 -0.14 1.04 -2.27 0.00 0.00 179.45 178.28 1ce8 n GLN 967 N -4.05 1.09 -0.51 1.90 1.13 -1.06 -4.91 117.38 110.96 1ce8 n GLN 967 Ca -0.03 -0.59 0.00 0.00 -1.94 0.00 0.00 57.00 54.44 1ce8 n GLN 967 Cb 0.15 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.01 1ce8 n GLN 967 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ce8 n GLY 968 N 1.27 0.71 3.78 1.08 0.00 -0.52 -4.81 105.19 106.70 1ce8 n GLY 968 Ca 0.15 -0.34 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 1ce8 n GLY 968 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ce8 s PHE 969 N -2.00 3.61 0.31 1.61 0.40 0.29 -4.51 117.98 117.69 1ce8 s PHE 969 Ca 0.00 1.75 -0.10 0.00 -0.60 0.00 0.00 56.93 57.99 1ce8 s PHE 969 Cb 0.00 -2.95 -0.07 0.00 0.51 0.00 0.00 43.02 40.51 1ce8 s PHE 969 CO 0.00 0.07 0.65 -1.21 0.70 0.00 0.00 175.22 175.43 1ce8 s GLU 970 N -2.17 3.79 0.15 0.44 2.02 0.18 -4.24 118.70 118.87 1ce8 s GLU 970 Ca 0.52 0.33 0.10 0.00 0.02 0.00 0.00 54.97 55.94 1ce8 s GLU 970 Cb -0.19 -2.53 -0.04 0.00 0.10 0.00 0.00 34.13 31.47 1ce8 s GLU 970 CO 0.24 0.15 -0.23 -0.51 0.02 0.00 0.00 175.26 174.93 1ce8 s LEU 971 N -3.35 2.37 0.04 1.80 1.43 -1.26 -1.44 118.68 118.27 1ce8 s LEU 971 Ca 0.49 -0.80 0.03 0.00 -1.03 0.00 0.00 54.13 52.82 1ce8 s LEU 971 Cb -0.11 -1.07 -0.02 0.00 0.03 0.00 0.00 46.19 45.02 1ce8 s LEU 971 CO 0.26 0.10 -0.10 -1.81 0.23 0.00 0.00 176.35 175.03 1ce8 s ASP 972 N -2.34 1.14 -0.00 2.29 1.11 -0.77 -0.03 116.67 118.06 1ce8 s ASP 972 Ca 0.15 -0.44 -0.24 0.00 0.18 0.00 0.00 52.55 52.21 1ce8 s ASP 972 Cb -0.09 -0.04 0.05 0.00 1.07 0.00 0.00 42.92 43.92 1ce8 s ASP 972 CO 0.07 -0.07 0.53 0.00 1.18 0.00 0.00 175.17 176.88 1ce8 s ALA 973 N -0.96 -1.36 0.64 5.23 0.00 -0.13 -0.74 121.76 124.44 1ce8 s ALA 973 Ca -0.03 0.79 -0.11 0.00 0.00 0.00 0.00 51.96 52.60 1ce8 s ALA 973 Cb -0.08 0.18 -0.03 0.00 0.00 0.00 0.00 23.12 23.19 1ce8 s ALA 973 CO 0.01 -0.40 1.04 0.95 0.00 0.00 0.00 175.76 177.35 1ce8 s THR 974 N -1.76 4.52 0.00 0.00 -4.23 -1.07 -2.13 115.64 110.98 1ce8 s THR 974 Ca -0.09 0.82 0.00 0.00 -1.18 0.00 0.00 61.69 61.24 1ce8 s THR 974 Cb -0.01 -3.76 0.00 0.00 1.34 0.00 0.00 72.50 70.07 1ce8 s THR 974 CO 0.04 -1.07 0.63 1.57 -0.54 0.00 0.00 174.62 175.25 1ce8 n HIS 975 N -2.84 0.00 -0.11 3.99 -0.00 -1.26 -0.01 115.22 114.99 1ce8 n HIS 975 Ca 0.06 0.00 0.06 0.00 0.46 0.00 0.00 57.72 58.30 1ce8 n HIS 975 Cb 0.54 -0.29 0.38 0.00 -0.12 0.00 0.00 29.99 30.51 1ce8 n HIS 975 CO 0.00 0.00 0.00 0.78 0.46 0.00 0.00 176.34 177.58 1ce8 h GLY 976 N 0.00 0.79 1.60 1.57 0.00 -1.97 0.85 103.07 105.91 1ce8 h GLY 976 Ca 0.00 -0.27 -0.16 0.00 0.00 0.00 0.00 47.33 46.90 1ce8 h GLY 976 CO 0.00 0.23 -0.59 -0.84 0.00 0.00 0.00 176.54 175.34 1ce8 h THR 977 N 0.68 1.35 -0.14 4.70 2.02 -1.65 -2.85 112.91 117.02 1ce8 h THR 977 Ca 0.25 -1.90 -0.11 0.00 0.77 0.00 0.00 66.41 65.42 1ce8 h THR 977 Cb 0.14 1.90 -0.01 0.00 -1.74 0.00 0.00 68.15 68.44 1ce8 h THR 977 CO -0.07 0.58 -0.39 0.00 0.37 0.00 0.00 175.52 176.00 1ce8 h ALA 978 N 1.06 1.07 0.29 6.16 0.00 0.88 -2.35 119.26 126.36 1ce8 h ALA 978 Ca -0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 1ce8 h ALA 978 Cb 1.12 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 1ce8 h ALA 978 CO 0.10 0.59 -0.16 0.82 0.00 0.00 0.00 179.25 180.61 1ce8 h ILE 979 N 0.26 0.67 -0.81 0.00 1.08 -0.65 -1.74 117.51 116.32 1ce8 h ILE 979 Ca 0.03 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.46 1ce8 h ILE 979 Cb 0.81 0.67 -0.04 0.00 -3.07 0.00 0.00 36.82 35.19 1ce8 h ILE 979 CO 0.06 0.00 0.37 0.58 -0.69 0.00 0.00 178.15 178.48 1ce8 h VAL 980 N -0.42 1.26 0.26 1.67 2.07 -1.51 -0.65 116.25 118.93 1ce8 h VAL 980 Ca -0.03 -0.74 -0.01 0.00 0.82 0.00 0.00 66.70 66.73 1ce8 h VAL 980 Cb 0.34 0.24 -0.00 0.00 -1.52 0.00 0.00 31.29 30.34 1ce8 h VAL 980 CO 0.05 0.31 -0.15 -0.07 0.02 0.00 0.00 177.57 177.73 1ce8 h LEU 981 N 1.16 -0.37 -0.72 2.57 3.38 -1.33 -2.51 115.31 117.50 1ce8 h LEU 981 Ca 0.28 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.35 1ce8 h LEU 981 Cb 0.15 0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.93 1ce8 h LEU 981 CO -0.03 -0.25 0.38 1.23 0.09 0.00 0.00 178.44 179.86 1ce8 h GLY 982 N -0.39 1.07 1.83 0.83 0.00 0.15 0.56 103.07 107.12 1ce8 h GLY 982 Ca -0.03 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1ce8 h GLY 982 CO 0.04 0.10 0.07 0.83 0.00 0.00 0.00 176.54 177.57 1ce8 h GLU 983 N 0.65 0.00 -0.47 4.80 4.39 -0.70 -0.27 114.58 122.98 1ce8 h GLU 983 Ca 0.34 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.04 1ce8 h GLU 983 Cb 0.32 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1ce8 h GLU 983 CO -0.24 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 177.61 1ce8 n ALA 984 N -1.77 2.29 -0.27 3.43 0.00 0.19 -4.94 120.51 119.44 1ce8 n ALA 984 Ca -0.02 -1.25 0.00 0.00 0.00 0.00 0.00 53.44 52.18 1ce8 n ALA 984 Cb 0.10 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 18.94 1ce8 n ALA 984 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ce8 n GLY 985 N 0.84 0.64 3.47 0.00 0.00 -0.11 -5.04 105.19 104.99 1ce8 n GLY 985 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 1ce8 n GLY 985 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ce8 s ILE 986 N -2.54 4.20 -0.60 -0.61 1.01 -0.81 -4.97 121.20 116.87 1ce8 s ILE 986 Ca 0.00 -0.22 -0.03 0.00 0.00 0.00 0.00 60.65 60.40 1ce8 s ILE 986 Cb 0.00 -2.92 0.16 0.00 0.01 0.00 0.00 42.46 39.70 1ce8 s ILE 986 CO 0.00 0.40 0.42 0.20 0.00 0.00 0.00 174.94 175.96 1ce8 s ASN 987 N 1.17 5.28 0.94 3.58 0.02 -1.26 -0.50 114.94 124.17 1ce8 s ASN 987 Ca 0.04 -2.75 -0.13 0.00 -1.02 0.00 0.00 52.86 48.99 1ce8 s ASN 987 Cb -0.14 -1.86 0.16 0.00 0.02 0.00 0.00 41.25 39.42 1ce8 s ASN 987 CO 0.02 -0.40 1.16 -2.16 0.02 0.00 0.00 177.10 175.75 1ce8 s PRO 988 N 0.08 0.91 -0.03 -0.60 0.04 -1.26 -4.94 135.00 129.20 1ce8 s PRO 988 Ca 0.16 0.16 -0.25 0.00 0.04 0.00 0.00 61.00 61.11 1ce8 s PRO 988 Cb -0.20 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 1ce8 s PRO 988 CO -0.04 -2.33 0.76 0.50 0.04 0.00 0.00 177.00 175.94 1ce8 s ARG 989 N -5.38 4.47 0.10 4.56 3.52 0.96 -4.85 118.95 122.33 1ce8 s ARG 989 Ca 0.66 1.02 -0.28 0.00 -0.13 0.00 0.00 55.73 56.99 1ce8 s ARG 989 Cb -0.13 -3.43 -0.06 0.00 -1.56 0.00 0.00 34.95 29.77 1ce8 s ARG 989 CO 0.53 0.10 0.89 -1.17 -0.81 0.00 0.00 175.30 174.84 1ce8 s LEU 990 N 0.63 4.49 0.09 -0.88 2.96 -1.26 -0.96 118.68 123.76 1ce8 s LEU 990 Ca 0.40 1.68 0.10 0.00 -0.22 0.00 0.00 54.13 56.09 1ce8 s LEU 990 Cb -0.19 -3.46 -0.03 0.00 0.50 0.00 0.00 46.19 43.01 1ce8 s LEU 990 CO 0.21 -0.02 -0.26 0.54 -1.32 0.00 0.00 176.35 175.50 1ce8 s VAL 991 N -0.13 2.17 0.04 1.68 0.11 -0.91 -4.90 120.40 118.48 1ce8 s VAL 991 Ca 0.43 -1.57 -0.19 0.00 -2.93 0.00 0.00 61.98 57.72 1ce8 s VAL 991 Cb -0.22 -1.90 -0.06 0.00 -1.53 0.00 0.00 36.38 32.67 1ce8 s VAL 991 CO 0.27 0.21 0.55 0.20 -3.33 0.00 0.00 175.10 173.00 1ce8 s ASN 992 N -1.66 7.00 1.00 3.54 0.02 -1.25 -4.25 114.94 119.33 1ce8 s ASN 992 Ca 0.13 1.19 -0.12 0.00 -1.02 0.00 0.00 52.86 53.03 1ce8 s ASN 992 Cb -0.10 -2.34 0.19 0.00 0.02 0.00 0.00 41.25 39.01 1ce8 s ASN 992 CO 0.04 0.25 1.09 -0.54 0.02 0.00 0.00 177.10 177.96 1ce8 s LYS 993 N -0.90 0.45 0.11 -0.60 1.02 -1.26 -1.41 119.74 117.15 1ce8 s LYS 993 Ca 0.28 0.56 -0.29 0.00 0.02 0.00 0.00 55.97 56.54 1ce8 s LYS 993 Cb -0.19 -1.74 -0.10 0.00 -0.52 0.00 0.00 37.83 35.29 1ce8 s LYS 993 CO 0.18 -2.73 1.61 0.28 -0.92 0.00 0.00 175.35 173.78 1ce8 h VAL 994 N -1.89 0.30 0.00 3.17 2.07 -1.95 -1.33 116.25 116.62 1ce8 h VAL 994 Ca -0.54 0.00 0.00 0.00 0.82 0.00 0.00 66.70 66.98 1ce8 h VAL 994 Cb 1.32 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1ce8 h VAL 994 CO 0.57 0.00 0.00 1.12 0.02 0.00 0.00 177.57 179.28 1ce8 h HIS 995 N -0.61 0.00 0.00 1.57 2.07 -2.00 -3.06 115.15 113.13 1ce8 h HIS 995 Ca 0.01 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.53 1ce8 h HIS 995 Cb 0.61 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.59 1ce8 h HIS 995 CO -0.26 0.00 0.00 0.39 -3.07 0.00 0.00 177.93 174.99 1ce8 n GLU 996 N -2.78 0.25 0.00 5.12 1.02 -0.51 -5.04 120.64 118.70 1ce8 n GLU 996 Ca -0.01 0.25 0.00 0.00 -0.02 0.00 0.00 57.16 57.38 1ce8 n GLU 996 Cb 0.15 -1.81 0.00 0.00 -0.02 0.00 0.00 31.44 29.75 1ce8 n GLU 996 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ce8 n GLY 997 N 1.08 0.86 3.15 0.62 0.00 -1.16 -4.87 105.19 104.87 1ce8 n GLY 997 Ca 0.05 -1.98 -0.15 0.00 0.00 0.00 0.00 46.02 43.93 1ce8 n GLY 997 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ce8 s ARG 998 N -1.55 0.77 0.60 1.61 0.52 -1.26 -3.12 118.95 116.52 1ce8 s ARG 998 Ca 0.00 -1.01 -0.06 0.00 -0.52 0.00 0.00 55.73 54.13 1ce8 s ARG 998 Cb 0.00 -0.56 0.01 0.00 0.52 0.00 0.00 34.95 34.92 1ce8 s ARG 998 CO 0.00 0.10 0.92 -2.14 0.02 0.00 0.00 175.30 174.20 1ce8 s PRO 999 N -2.22 2.92 0.46 3.54 0.02 -1.26 -5.03 135.00 133.43 1ce8 s PRO 999 Ca -0.00 0.05 0.07 0.00 0.02 0.00 0.00 61.00 61.14 1ce8 s PRO 999 Cb -0.06 -2.24 -0.01 0.00 0.02 0.00 0.00 34.50 32.20 1ce8 s PRO 999 CO 0.01 -0.73 0.34 -3.38 -0.33 0.00 0.00 177.00 172.90 1ce8 s HIS 1000N -3.03 2.27 0.26 6.54 -3.43 -1.18 -3.92 115.29 112.79 1ce8 s HIS 1000Ca 0.54 -0.65 -0.12 0.00 -0.80 0.00 0.00 55.06 54.03 1ce8 s HIS 1000Cb -0.11 -2.02 0.37 0.00 -1.43 0.00 0.00 32.58 29.39 1ce8 s HIS 1000CO 0.46 -0.18 1.56 -0.84 -2.00 0.00 0.00 174.74 173.75 1ce8 h ILE 1001N 1.03 0.04 -0.62 -5.38 3.07 -1.51 0.51 117.51 114.65 1ce8 h ILE 1001Ca -0.40 0.00 0.08 0.00 1.55 0.00 0.00 64.86 66.09 1ce8 h ILE 1001Cb 1.28 0.04 -0.06 0.00 -0.27 0.00 0.00 36.82 37.80 1ce8 h ILE 1001CO 0.61 0.00 0.27 -0.61 -1.05 0.00 0.00 178.15 177.37 1ce8 h GLN 1002N -0.01 0.48 -0.01 0.16 -0.00 -1.93 0.29 115.11 114.10 1ce8 h GLN 1002Ca 0.42 -0.03 -0.00 0.00 -0.00 0.00 0.00 58.65 59.04 1ce8 h GLN 1002Cb 0.66 -0.11 -0.00 0.00 0.00 0.00 0.00 27.48 28.04 1ce8 h GLN 1002CO -0.97 0.32 0.00 -0.44 0.00 0.00 0.00 178.83 177.73 1ce8 h ASP 1003N 0.49 0.01 -0.03 -0.69 3.32 -1.32 0.10 116.42 118.30 1ce8 h ASP 1003Ca 0.30 -0.17 0.01 0.00 0.02 0.00 0.00 57.03 57.19 1ce8 h ASP 1003Cb 0.31 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 1ce8 h ASP 1003CO -0.26 0.17 -0.02 0.03 -1.72 0.00 0.00 179.24 177.44 1ce8 h ARG 1004N -0.16 -0.03 0.11 3.56 3.08 -0.78 0.15 114.38 120.32 1ce8 h ARG 1004Ca 0.00 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.07 1ce8 h ARG 1004Cb 0.17 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.18 1ce8 h ARG 1004CO -0.00 -0.02 -0.36 0.82 -1.07 0.00 0.00 179.97 179.34 1ce8 h ILE 1005N -0.03 0.25 -0.55 2.04 2.04 -0.37 0.15 117.51 121.04 1ce8 h ILE 1005Ca 0.02 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.04 1ce8 h ILE 1005Cb 0.06 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.37 1ce8 h ILE 1005CO -0.05 0.00 0.42 0.50 0.00 0.00 0.00 178.15 179.02 1ce8 h LYS 1006N -0.59 0.00 -0.14 2.37 3.64 -0.48 0.09 116.57 121.47 1ce8 h LYS 1006Ca 0.03 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1ce8 h LYS 1006Cb 0.62 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1ce8 h LYS 1006CO -0.22 0.00 0.00 0.09 -2.27 0.00 0.00 179.45 177.05 1ce8 n ASN 1007N -4.27 1.15 -0.57 4.20 4.13 0.50 -4.88 115.26 115.52 1ce8 n ASN 1007Ca 0.10 -1.71 -0.06 0.00 1.68 0.00 0.00 54.58 54.60 1ce8 n ASN 1007Cb 0.64 -0.09 -0.01 0.00 -1.54 0.00 0.00 39.78 38.78 1ce8 n ASN 1007CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ce8 n GLY 1008N 0.98 0.34 0.24 7.41 0.00 0.02 -4.94 105.19 109.23 1ce8 n GLY 1008Ca 0.14 -0.70 0.11 0.00 0.00 0.00 0.00 46.02 45.56 1ce8 n GLY 1008CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1ce8 h GLU 1009N 0.00 0.00 -6.11 1.61 4.39 -1.26 -3.45 114.58 109.75 1ce8 h GLU 1009Ca -0.13 0.00 -0.57 0.00 0.34 0.00 0.00 59.36 59.01 1ce8 h GLU 1009Cb 0.88 0.00 -0.16 0.00 -0.10 0.00 0.00 28.75 29.37 1ce8 h GLU 1009CO 0.16 0.19 -0.78 0.71 -1.16 0.00 0.00 179.01 178.13 1ce8 s TYR 1010N -3.81 2.06 -0.00 4.33 2.02 -1.26 -4.46 117.35 116.22 1ce8 s TYR 1010Ca -0.01 -0.42 0.00 0.00 -0.37 0.00 0.00 57.07 56.28 1ce8 s TYR 1010Cb 0.11 -0.97 -0.00 0.00 -0.40 0.00 0.00 41.96 40.70 1ce8 s TYR 1010CO 0.62 0.49 0.01 0.25 -1.57 0.00 0.00 175.55 175.35 1ce8 n THR 1011N -0.10 0.00 -3.74 -0.71 -2.24 -0.72 -4.92 114.28 101.85 1ce8 n THR 1011Ca -0.10 -0.17 -0.13 0.00 -2.27 0.00 0.00 64.05 61.38 1ce8 n THR 1011Cb 0.58 0.67 -0.09 0.00 -2.10 0.00 0.00 70.33 69.39 1ce8 n THR 1011CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1ce8 s TYR 1012N -1.68 -0.31 -0.02 4.78 5.04 -1.12 -3.75 117.35 120.29 1ce8 s TYR 1012Ca -0.00 0.66 -0.00 0.00 -2.44 0.00 0.00 57.07 55.29 1ce8 s TYR 1012Cb 0.00 0.13 0.03 0.00 0.35 0.00 0.00 41.96 42.47 1ce8 s TYR 1012CO 0.01 -0.30 0.03 0.42 -1.34 0.00 0.00 175.55 174.37 1ce8 s ILE 1013N -0.55 -0.05 -0.24 3.14 1.01 -0.90 -0.18 121.20 123.42 1ce8 s ILE 1013Ca -0.07 0.23 -0.02 0.00 0.00 0.00 0.00 60.65 60.79 1ce8 s ILE 1013Cb -0.04 -0.09 0.02 0.00 0.01 0.00 0.00 42.46 42.36 1ce8 s ILE 1013CO 0.03 0.10 -0.05 -0.51 0.00 0.00 0.00 174.94 174.50 1ce8 s ILE 1014N 1.15 3.01 -0.20 2.92 1.10 0.90 -1.46 121.20 128.62 1ce8 s ILE 1014Ca -0.08 -0.91 -0.02 0.00 -0.51 0.00 0.00 60.65 59.13 1ce8 s ILE 1014Cb -0.13 -2.49 0.06 0.00 0.15 0.00 0.00 42.46 40.04 1ce8 s ILE 1014CO -0.03 0.24 0.00 0.21 -2.11 0.00 0.00 174.94 173.25 1ce8 s ASN 1015N 1.36 3.08 0.14 4.50 3.04 -0.51 -1.63 114.94 124.92 1ce8 s ASN 1015Ca 0.01 -0.86 0.08 0.00 0.04 0.00 0.00 52.86 52.14 1ce8 s ASN 1015Cb -0.16 -0.77 -0.04 0.00 -1.54 0.00 0.00 41.25 38.74 1ce8 s ASN 1015CO -0.04 -0.27 -0.11 0.42 -3.04 0.00 0.00 177.10 174.05 1ce8 s THR 1016N 1.72 3.17 -0.20 -5.21 -4.23 -0.34 -4.30 115.64 106.25 1ce8 s THR 1016Ca -0.02 -1.51 -0.18 0.00 -1.18 0.00 0.00 61.69 58.80 1ce8 s THR 1016Cb -0.17 -2.52 0.05 0.00 1.34 0.00 0.00 72.50 71.20 1ce8 s THR 1016CO -0.07 -0.00 0.53 -0.89 -0.54 0.00 0.00 174.62 173.65 1ce8 s THR 1017N -1.44 -0.00 -0.01 3.99 2.01 -1.26 -2.47 115.64 116.45 1ce8 s THR 1017Ca 0.22 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.26 1ce8 s THR 1017Cb -0.10 -0.75 -0.01 0.00 0.01 0.00 0.00 72.50 71.66 1ce8 s THR 1017CO 0.14 0.00 -0.11 -0.55 -0.69 0.00 0.00 174.62 173.41 1ce8 s SER 1018N 0.37 1.33 0.00 3.53 0.15 -1.26 -4.93 113.70 112.89 1ce8 s SER 1018Ca -0.01 -0.21 0.00 0.00 0.70 0.00 0.00 55.95 56.44 1ce8 s SER 1018Cb -0.04 -0.18 0.00 0.00 -1.71 0.00 0.00 66.02 64.09 1ce8 s SER 1018CO -0.00 0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.18 1ce8 n GLY 1019N 2.87 -0.68 0.33 9.45 0.00 -1.26 -4.49 105.19 111.41 1ce8 n GLY 1019Ca -0.14 -1.18 -0.00 0.00 0.00 0.00 0.00 46.02 44.70 1ce8 n GLY 1019CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ce8 n ARG 1020N 1.37 -0.20 -0.13 1.61 3.00 -1.26 -0.01 116.66 121.04 1ce8 n ARG 1020Ca 0.00 1.35 -0.10 0.00 -0.00 0.00 0.00 57.85 59.10 1ce8 n ARG 1020Cb 0.00 -2.00 -0.01 0.00 0.00 0.00 0.00 32.46 30.44 1ce8 n ARG 1020CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 1ce8 h ARG 1021N 0.00 0.62 -0.29 -0.14 1.12 -1.98 -0.19 114.38 113.52 1ce8 h ARG 1021Ca 0.31 -0.16 0.01 0.00 -1.11 0.00 0.00 59.98 59.04 1ce8 h ARG 1021Cb 0.53 -0.08 -0.02 0.00 -0.01 0.00 0.00 29.97 30.40 1ce8 h ARG 1021CO -0.87 0.67 0.17 0.00 -3.11 0.00 0.00 179.97 176.83 1ce8 h ALA 1022N 0.93 0.36 0.13 2.80 0.00 -1.09 0.27 119.26 122.67 1ce8 h ALA 1022Ca 0.12 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1ce8 h ALA 1022Cb 0.33 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1ce8 h ALA 1022CO 0.00 -0.20 -0.25 0.82 0.00 0.00 0.00 179.25 179.62 1ce8 h ILE 1023N 0.35 0.45 -0.92 0.00 2.04 -0.28 0.51 117.51 119.66 1ce8 h ILE 1023Ca 0.11 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.10 1ce8 h ILE 1023Cb -0.01 0.45 -0.07 0.00 -0.74 0.00 0.00 36.82 36.45 1ce8 h ILE 1023CO -0.05 0.00 0.59 -0.33 0.00 0.00 0.00 178.15 178.36 1ce8 h GLU 1024N -0.46 0.78 0.00 2.37 5.08 -0.71 -0.34 114.58 121.30 1ce8 h GLU 1024Ca 0.03 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 58.21 1ce8 h GLU 1024Cb 0.48 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 1ce8 h GLU 1024CO -0.13 0.52 -0.60 -0.44 -1.00 0.00 0.00 179.01 177.35 1ce8 h ASP 1025N 0.80 0.00 0.48 1.42 3.32 0.12 -3.22 116.42 119.34 1ce8 h ASP 1025Ca 0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.50 1ce8 h ASP 1025Cb 0.60 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.15 1ce8 h ASP 1025CO -0.22 0.60 -0.25 -1.54 -1.72 0.00 0.00 179.24 176.11 1ce8 n SER 1026N -3.74 0.52 -0.29 6.45 3.41 0.01 -4.53 113.62 115.45 1ce8 n SER 1026Ca -0.01 -0.37 0.07 0.00 -0.26 0.00 0.00 58.87 58.30 1ce8 n SER 1026Cb 0.61 0.01 0.15 0.00 -0.26 0.00 0.00 64.21 64.72 1ce8 n SER 1026CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1ce8 n ARG 1027N -1.15 -0.07 -0.34 4.33 0.63 -0.69 -1.56 116.66 117.81 1ce8 n ARG 1027Ca 0.10 1.24 0.14 0.00 -0.92 0.00 0.00 57.85 58.41 1ce8 n ARG 1027Cb 0.32 -1.89 0.34 0.00 0.45 0.00 0.00 32.46 31.69 1ce8 n ARG 1027CO 0.00 0.00 0.00 -0.24 -2.51 0.00 0.00 177.63 174.88 1ce8 h VAL 1028N 0.00 0.69 0.02 5.15 3.04 -1.86 -1.53 116.25 121.77 1ce8 h VAL 1028Ca 0.42 -0.25 -0.00 0.00 -1.01 0.00 0.00 66.70 65.86 1ce8 h VAL 1028Cb 0.71 -0.09 0.00 0.00 -2.01 0.00 0.00 31.29 29.89 1ce8 h VAL 1028CO -0.81 0.13 -0.01 -0.29 -1.01 0.00 0.00 177.57 175.58 1ce8 h ILE 1029N 0.72 1.14 -0.96 3.17 2.10 -1.65 -0.58 117.51 121.45 1ce8 h ILE 1029Ca 0.58 -0.49 0.04 0.00 1.08 0.00 0.00 64.86 66.06 1ce8 h ILE 1029Cb 0.95 1.47 -0.06 0.00 -1.09 0.00 0.00 36.82 38.10 1ce8 h ILE 1029CO -0.37 0.13 0.63 0.03 -1.08 0.00 0.00 178.15 177.48 1ce8 h ARG 1030N -0.24 1.15 -0.38 2.19 3.08 -1.62 0.23 114.38 118.79 1ce8 h ARG 1030Ca -0.00 -0.07 -0.09 0.00 0.07 0.00 0.00 59.98 59.89 1ce8 h ARG 1030Cb 0.23 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1ce8 h ARG 1030CO 0.00 0.76 -0.12 0.00 -1.07 0.00 0.00 179.97 179.54 1ce8 h ARG 1031N 1.18 0.76 -0.12 0.04 3.08 -1.16 -0.96 114.38 117.20 1ce8 h ARG 1031Ca 0.39 -0.30 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1ce8 h ARG 1031Cb 0.04 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 1ce8 h ARG 1031CO -0.13 0.91 0.03 0.77 -1.07 0.00 0.00 179.97 180.49 1ce8 h SER 1032N 0.56 0.18 -0.32 7.04 0.02 -0.38 -2.04 113.55 118.62 1ce8 h SER 1032Ca 0.09 -0.23 0.06 0.00 -0.84 0.00 0.00 61.79 60.88 1ce8 h SER 1032Cb 0.65 -0.05 -0.06 0.00 0.14 0.00 0.00 62.40 63.08 1ce8 h SER 1032CO 0.04 0.37 -0.08 0.00 -1.14 0.00 0.00 176.83 176.02 1ce8 h ALA 1033N 0.82 0.21 -0.30 3.77 0.00 -0.51 0.29 119.26 123.54 1ce8 h ALA 1033Ca 0.04 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1ce8 h ALA 1033Cb 0.25 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1ce8 h ALA 1033CO 0.00 -0.46 0.20 1.25 0.00 0.00 0.00 179.25 180.24 1ce8 h LEU 1034N 0.00 0.36 -1.40 0.00 5.85 -1.14 -1.22 115.31 117.77 1ce8 h LEU 1034Ca 0.15 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 1ce8 h LEU 1034Cb 0.23 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 1ce8 h LEU 1034CO -0.33 0.27 0.11 -0.61 -0.34 0.00 0.00 178.44 177.55 1ce8 h GLN 1035N 0.40 0.52 -0.67 1.25 4.15 -0.60 -2.49 115.11 117.67 1ce8 h GLN 1035Ca 0.11 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.46 1ce8 h GLN 1035Cb -0.03 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.57 1ce8 h GLN 1035CO -0.02 0.46 0.00 0.66 -1.93 0.00 0.00 178.83 178.00 1ce8 n TYR 1036N -4.36 1.16 -2.82 3.99 4.01 0.96 -4.93 117.16 115.16 1ce8 n TYR 1036Ca 0.02 -0.51 -0.21 0.00 -0.16 0.00 0.00 57.90 57.05 1ce8 n TYR 1036Cb 0.16 -0.12 0.02 0.00 -0.31 0.00 0.00 39.34 39.10 1ce8 n TYR 1036CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1ce8 n LYS 1037N 1.28 -3.84 -3.21 -0.72 4.76 -0.93 -4.99 118.16 110.51 1ce8 n LYS 1037Ca 0.24 0.88 -0.39 0.00 -2.87 0.00 0.00 58.31 56.17 1ce8 n LYS 1037Cb 0.71 -5.58 -0.06 0.00 -1.84 0.00 0.00 35.03 28.27 1ce8 n LYS 1037CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1ce8 s VAL 1038N -3.10 5.12 0.23 -0.18 1.01 -0.50 -4.75 120.40 118.23 1ce8 s VAL 1038Ca 0.21 1.12 -0.31 0.00 0.00 0.00 0.00 61.98 63.00 1ce8 s VAL 1038Cb -0.09 -3.90 -0.11 0.00 0.00 0.00 0.00 36.38 32.28 1ce8 s VAL 1038CO 0.26 0.26 1.61 -2.28 0.00 0.00 0.00 175.10 174.96 1ce8 s HIS 1039N 0.96 2.91 0.01 5.22 2.46 -1.25 -4.62 115.29 120.97 1ce8 s HIS 1039Ca 0.29 0.63 -0.02 0.00 0.47 0.00 0.00 55.06 56.43 1ce8 s HIS 1039Cb -0.16 -4.03 -0.01 0.00 -0.13 0.00 0.00 32.58 28.25 1ce8 s HIS 1039CO 0.12 -3.68 0.02 1.52 -2.47 0.00 0.00 174.74 170.26 1ce8 s TYR 1040N 0.66 0.16 0.01 3.88 -0.85 -1.26 -2.12 117.35 117.83 1ce8 s TYR 1040Ca 0.68 -0.33 0.08 0.00 -0.52 0.00 0.00 57.07 56.98 1ce8 s TYR 1040Cb -0.47 -0.12 -0.02 0.00 0.38 0.00 0.00 41.96 41.73 1ce8 s TYR 1040CO 0.38 -0.19 -0.24 -0.51 -1.52 0.00 0.00 175.55 173.47 1ce8 s ASP 1041N -1.22 2.82 -0.11 -0.18 1.01 -0.53 -5.00 116.67 113.46 1ce8 s ASP 1041Ca -0.13 -0.49 0.15 0.00 0.71 0.00 0.00 52.55 52.79 1ce8 s ASP 1041Cb -0.08 -0.28 0.49 0.00 1.01 0.00 0.00 42.92 44.06 1ce8 s ASP 1041CO -0.00 0.26 1.41 0.35 0.21 0.00 0.00 175.17 177.39 1ce8 n THR 1042N 2.18 1.80 -3.92 -1.27 -2.24 -1.26 -1.42 114.28 108.15 1ce8 n THR 1042Ca -0.16 -1.46 -0.10 0.00 -2.27 0.00 0.00 64.05 60.05 1ce8 n THR 1042Cb 0.52 0.06 -0.12 0.00 -2.10 0.00 0.00 70.33 68.69 1ce8 n THR 1042CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1ce8 s THR 1043N -2.06 0.06 0.09 4.28 -4.23 -1.26 -4.69 115.64 107.82 1ce8 s THR 1043Ca 0.37 -0.53 -0.17 0.00 -1.18 0.00 0.00 61.69 60.19 1ce8 s THR 1043Cb 0.27 -0.20 -0.09 0.00 1.34 0.00 0.00 72.50 73.82 1ce8 s THR 1043CO 0.14 -0.29 1.43 0.25 -0.54 0.00 0.00 174.62 175.60 1ce8 h LEU 1044N 5.17 0.62 -0.86 4.79 5.85 -1.94 -1.06 115.31 127.88 1ce8 h LEU 1044Ca -0.29 -0.44 0.16 0.00 0.84 0.00 0.00 57.88 58.15 1ce8 h LEU 1044Cb 1.21 -0.17 -0.10 0.00 0.37 0.00 0.00 40.66 41.96 1ce8 h LEU 1044CO 0.44 0.93 0.43 0.78 -0.34 0.00 0.00 178.44 180.68 1ce8 h ASN 1045N 0.32 0.50 0.42 1.25 2.35 -1.96 0.34 115.58 118.79 1ce8 h ASN 1045Ca 0.05 0.10 -0.09 0.00 -0.55 0.00 0.00 56.30 55.82 1ce8 h ASN 1045Cb 0.72 0.03 -0.01 0.00 0.05 0.00 0.00 38.32 39.11 1ce8 h ASN 1045CO 0.05 0.18 -0.41 1.23 -1.65 0.00 0.00 177.43 176.83 1ce8 h GLY 1046N 0.58 0.00 0.97 2.83 0.00 -1.74 -2.66 103.07 103.06 1ce8 h GLY 1046Ca 0.48 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.71 1ce8 h GLY 1046CO -0.39 0.00 -0.22 -1.33 0.00 0.00 0.00 176.54 174.60 1ce8 h GLY 1047N 1.24 0.78 0.98 4.60 0.00 0.95 -2.13 103.07 109.50 1ce8 h GLY 1047Ca -0.00 -0.75 0.00 0.00 0.00 0.00 0.00 47.33 46.58 1ce8 h GLY 1047CO 0.05 0.68 0.12 0.74 0.00 0.00 0.00 176.54 178.13 1ce8 h PHE 1048N 0.49 0.23 -0.17 5.60 0.04 -1.09 0.09 116.94 122.12 1ce8 h PHE 1048Ca 0.06 0.01 0.04 0.00 2.80 0.00 0.00 57.97 60.88 1ce8 h PHE 1048Cb 0.77 -0.08 -0.03 0.00 2.20 0.00 0.00 35.95 38.81 1ce8 h PHE 1048CO 0.06 0.14 -0.05 0.00 -0.60 0.00 0.00 178.31 177.86 1ce8 h ALA 1049N 1.08 0.10 -0.80 2.45 0.00 -1.48 0.14 119.26 120.75 1ce8 h ALA 1049Ca 0.07 0.07 0.15 0.00 0.00 0.00 0.00 54.91 55.20 1ce8 h ALA 1049Cb -0.02 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 1ce8 h ALA 1049CO -0.02 -0.49 0.53 1.15 0.00 0.00 0.00 179.25 180.42 1ce8 h THR 1050N -0.02 0.80 -0.11 0.00 2.02 -0.96 -1.23 112.91 113.41 1ce8 h THR 1050Ca 0.08 -0.17 -0.11 0.00 0.77 0.00 0.00 66.41 66.98 1ce8 h THR 1050Cb 0.14 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 66.82 1ce8 h THR 1050CO -0.18 0.09 -0.36 0.00 0.37 0.00 0.00 175.52 175.44 1ce8 h ALA 1051N 1.63 0.20 -0.57 6.16 0.00 0.11 -3.13 119.26 123.66 1ce8 h ALA 1051Ca 0.40 -0.44 0.04 0.00 0.00 0.00 0.00 54.91 54.91 1ce8 h ALA 1051Cb 0.82 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 1ce8 h ALA 1051CO -0.15 0.27 0.38 0.52 0.00 0.00 0.00 179.25 180.27 1ce8 h MET 1052N 0.02 0.59 0.00 0.00 2.86 0.29 0.48 114.93 119.17 1ce8 h MET 1052Ca -0.01 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1ce8 h MET 1052Cb 0.98 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.51 1ce8 h MET 1052CO 0.08 0.39 0.00 0.00 1.06 0.00 0.00 176.91 178.44 1ce8 h ALA 1053N 1.68 1.00 0.00 6.32 0.00 -1.26 -2.34 119.26 124.66 1ce8 h ALA 1053Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1ce8 h ALA 1053Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1ce8 h ALA 1053CO -0.07 0.00 0.00 -0.07 0.00 0.00 0.00 179.25 179.11 1ce8 h LEU 1054N 0.00 0.00 -1.20 0.00 3.38 -0.84 -1.84 115.31 114.82 1ce8 h LEU 1054Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ce8 h LEU 1054Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1ce8 h LEU 1054CO 0.00 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.12 1ce8 n ASN 1055N -2.60 1.79 -4.55 -0.43 5.03 -0.88 -4.92 115.26 108.70 1ce8 n ASN 1055Ca 0.02 -1.75 -0.26 0.00 0.87 0.00 0.00 54.58 53.45 1ce8 n ASN 1055Cb 0.27 -0.13 -0.11 0.00 -1.02 0.00 0.00 39.78 38.80 1ce8 n ASN 1055CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ce8 s ALA 1056N -1.75 2.96 -0.39 5.41 0.00 -0.69 -5.03 121.76 122.26 1ce8 s ALA 1056Ca 0.32 -2.12 0.02 0.00 0.00 0.00 0.00 51.96 50.18 1ce8 s ALA 1056Cb 0.17 0.00 0.12 0.00 0.00 0.00 0.00 23.12 23.41 1ce8 s ALA 1056CO 0.26 0.04 0.16 0.34 0.00 0.00 0.00 175.76 176.55 1ce8 s ASP 1057N -3.62 4.10 0.14 0.00 -1.08 -1.26 -5.00 116.67 109.96 1ce8 s ASP 1057Ca 0.33 -2.29 0.09 0.00 -0.52 0.00 0.00 52.55 50.16 1ce8 s ASP 1057Cb 0.04 -1.20 0.50 0.00 -1.46 0.00 0.00 42.92 40.80 1ce8 s ASP 1057CO 0.17 -0.33 1.27 0.00 0.52 0.00 0.00 175.17 176.79 1ce8 n ALA 1058N 4.02 0.99 -0.24 3.66 0.00 -1.26 -0.49 120.51 127.18 1ce8 n ALA 1058Ca 0.04 0.09 0.05 0.00 0.00 0.00 0.00 53.44 53.61 1ce8 n ALA 1058Cb 0.38 -1.10 0.13 0.00 0.00 0.00 0.00 19.45 18.85 1ce8 n ALA 1058CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ce8 n THR 1059N -1.82 1.16 0.04 0.00 -2.24 -1.26 -4.63 114.28 105.53 1ce8 n THR 1059Ca -0.01 -1.13 -0.20 0.00 -2.27 0.00 0.00 64.05 60.45 1ce8 n THR 1059Cb 0.03 0.40 -0.12 0.00 -2.10 0.00 0.00 70.33 68.54 1ce8 n THR 1059CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1ce8 h GLU 1060N 1.45 0.48 -2.70 -0.78 4.81 -1.20 -3.46 114.58 113.17 1ce8 h GLU 1060Ca 0.00 -0.60 -0.12 0.00 -0.13 0.00 0.00 59.36 58.50 1ce8 h GLU 1060Cb 0.76 0.19 -0.26 0.00 0.63 0.00 0.00 28.75 30.06 1ce8 h GLU 1060CO 0.02 1.24 -0.31 0.21 -0.73 0.00 0.00 179.01 179.44 1ce8 s LYS 1061N -2.99 0.39 0.24 1.92 2.20 -1.26 -5.15 119.74 115.09 1ce8 s LYS 1061Ca -0.12 0.73 0.07 0.00 -0.36 0.00 0.00 55.97 56.29 1ce8 s LYS 1061Cb 0.04 0.00 -0.04 0.00 -1.51 0.00 0.00 37.83 36.33 1ce8 s LYS 1061CO 0.87 -0.14 0.20 0.14 -0.36 0.00 0.00 175.35 176.05 1ce8 s VAL 1062N 1.21 4.48 -0.20 4.02 -7.23 -1.26 -5.02 120.40 116.40 1ce8 s VAL 1062Ca -0.08 -1.36 -0.12 0.00 -1.81 0.00 0.00 61.98 58.60 1ce8 s VAL 1062Cb -0.08 -3.41 0.06 0.00 0.56 0.00 0.00 36.38 33.51 1ce8 s VAL 1062CO -0.10 -0.33 0.49 -0.51 -0.31 0.00 0.00 175.10 174.34 1ce8 s ILE 1063N -2.10 -0.02 0.64 -0.62 2.07 -1.26 -5.14 121.20 114.77 1ce8 s ILE 1063Ca 0.33 0.06 -0.13 0.00 -1.41 0.00 0.00 60.65 59.49 1ce8 s ILE 1063Cb -0.08 -0.72 -0.02 0.00 0.13 0.00 0.00 42.46 41.77 1ce8 s ILE 1063CO 0.25 0.02 1.05 -0.94 -1.91 0.00 0.00 174.94 173.41 1ce8 s SER 1064N 1.30 5.68 0.36 4.50 1.04 -1.26 -4.58 113.70 120.74 1ce8 s SER 1064Ca -0.08 1.69 0.10 0.00 0.48 0.00 0.00 55.95 58.13 1ce8 s SER 1064Cb -0.07 -2.51 0.67 0.00 0.10 0.00 0.00 66.02 64.21 1ce8 s SER 1064CO -0.13 -1.24 1.83 0.58 0.98 0.00 0.00 173.24 175.26 1ce8 h VAL 1065N -0.10 1.24 -0.41 5.02 2.07 0.10 -0.07 116.25 124.10 1ce8 h VAL 1065Ca -0.45 -1.14 -0.15 0.00 0.82 0.00 0.00 66.70 65.78 1ce8 h VAL 1065Cb 1.21 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 32.46 1ce8 h VAL 1065CO 0.58 0.34 -0.32 1.56 0.02 0.00 0.00 177.57 179.75 1ce8 h GLN 1066N 0.15 0.95 -0.81 1.57 7.50 -1.89 -2.21 115.11 120.37 1ce8 h GLN 1066Ca 0.02 -0.47 -0.01 0.00 0.50 0.00 0.00 58.65 58.69 1ce8 h GLN 1066Cb 0.59 0.00 -0.04 0.00 0.05 0.00 0.00 27.48 28.08 1ce8 h GLN 1066CO 0.04 1.13 0.45 0.93 -1.50 0.00 0.00 178.83 179.88 1ce8 h GLU 1067N 0.78 1.13 -0.57 1.46 5.08 -1.76 -0.89 114.58 119.80 1ce8 h GLU 1067Ca 0.08 -0.13 0.10 0.00 -1.00 0.00 0.00 59.36 58.41 1ce8 h GLU 1067Cb 0.91 -0.22 -0.08 0.00 0.50 0.00 0.00 28.75 29.86 1ce8 h GLU 1067CO 0.08 0.83 0.14 0.52 -1.00 0.00 0.00 179.01 179.58 1ce8 h MET 1068N 1.12 0.27 0.00 2.33 2.86 -0.67 0.01 114.93 120.86 1ce8 h MET 1068Ca 0.29 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.90 1ce8 h MET 1068Cb 0.02 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 31.62 1ce8 h MET 1068CO -0.05 0.18 -0.05 0.45 1.06 0.00 0.00 176.91 178.51 1ce8 h HIS 1069N 0.28 0.00 0.08 -0.22 3.86 -1.05 -3.07 115.15 115.03 1ce8 h HIS 1069Ca 0.29 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.50 1ce8 h HIS 1069Cb 0.41 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.88 1ce8 h HIS 1069CO -0.23 0.05 -0.04 0.00 0.86 0.00 0.00 177.93 178.57 1ce8 h ALA 1070N 1.95 -0.11 0.00 2.45 0.00 0.38 -2.10 119.26 121.83 1ce8 h ALA 1070Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1ce8 h ALA 1070Cb 0.96 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1ce8 h ALA 1070CO 0.01 -0.47 0.24 1.04 0.00 0.00 0.00 179.25 180.07 1ce8 n GLN 1071N -5.05 0.05 -2.94 0.00 6.02 -0.44 -4.50 117.38 110.52 1ce8 n GLN 1071Ca -0.08 0.45 -0.42 0.00 -0.01 0.00 0.00 57.00 56.93 1ce8 n GLN 1071Cb 0.15 -1.89 -0.05 0.00 1.02 0.00 0.00 30.24 29.47 1ce8 n GLN 1071CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1ce8 s ILE 1072N -2.99 4.73 -2.52 5.09 1.01 -0.79 -4.70 121.20 121.03 1ce8 s ILE 1072Ca -0.01 0.96 0.28 0.00 0.00 0.00 0.00 60.65 61.88 1ce8 s ILE 1072Cb 0.02 -4.21 0.53 0.00 0.01 0.00 0.00 42.46 38.82 1ce8 s ILE 1072CO 0.06 -0.41 1.72 0.29 0.00 0.00 0.00 174.94 176.61