#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 0.31 -1.99 2.12 -0.05 -1.26 -3.86 135.00 130.27 1ce8 n PRO 2 Ca 0.00 0.00 -0.41 0.00 -0.05 0.00 0.00 63.50 63.04 1ce8 n PRO 2 Cb 0.00 0.00 -0.02 0.00 -0.05 0.00 0.00 33.50 33.43 1ce8 n PRO 2 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 175.50 173.86 1ce8 s LYS 3 N -1.36 4.26 0.51 0.54 -2.85 -1.26 -4.09 119.74 115.48 1ce8 s LYS 3 Ca 0.00 2.32 -0.21 0.00 -1.00 0.00 0.00 55.97 57.09 1ce8 s LYS 3 Cb 0.00 -3.10 -0.09 0.00 -2.06 0.00 0.00 37.83 32.58 1ce8 s LYS 3 CO 0.00 -0.43 0.79 0.54 0.10 0.00 0.00 175.35 176.35 1ce8 n ARG 4 N 2.21 0.88 -0.05 1.78 1.74 -0.23 -4.97 116.66 118.02 1ce8 n ARG 4 Ca 0.06 0.33 -0.12 0.00 -0.77 0.00 0.00 57.85 57.35 1ce8 n ARG 4 Cb 0.40 -1.90 -0.14 0.00 -1.02 0.00 0.00 32.46 29.80 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 -1.22 1.57 0.30 0.55 5.66 -1.26 -4.36 114.28 115.53 1ce8 n THR 5 Ca 0.11 -0.77 0.19 0.00 -3.05 0.00 0.00 64.05 60.53 1ce8 n THR 5 Cb 0.44 -1.05 0.88 0.00 -1.55 0.00 0.00 70.33 69.05 1ce8 n THR 5 CO 0.00 0.00 0.00 -2.24 -3.05 0.00 0.00 175.07 169.78 1ce8 h ASP 6 N 0.01 0.00 -3.71 1.09 3.04 -2.00 -3.42 116.42 111.43 1ce8 h ASP 6 Ca -0.41 0.00 -0.67 0.00 -3.24 0.00 0.00 57.03 52.71 1ce8 h ASP 6 Cb 2.07 0.00 -0.20 0.00 -1.04 0.00 0.00 39.33 40.16 1ce8 h ASP 6 CO 0.05 0.02 -0.51 -0.63 -2.04 0.00 0.00 179.24 176.14 1ce8 s ILE 7 N -3.92 5.07 -0.15 4.15 1.01 -1.26 -4.91 121.20 121.18 1ce8 s ILE 7 Ca -0.02 -0.26 -0.03 0.00 0.00 0.00 0.00 60.65 60.35 1ce8 s ILE 7 Cb 0.11 -3.59 -0.08 0.00 0.01 0.00 0.00 42.46 38.91 1ce8 s ILE 7 CO 0.50 0.03 -0.17 0.29 0.00 0.00 0.00 174.94 175.60 1ce8 n LYS 8 N 5.06 0.36 -4.26 2.79 5.02 -1.26 -4.96 118.16 120.91 1ce8 n LYS 8 Ca -0.13 0.11 -0.33 0.00 -2.02 0.00 0.00 58.31 55.95 1ce8 n LYS 8 Cb 0.50 -1.19 -0.09 0.00 -0.02 0.00 0.00 35.03 34.23 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 -5.90 5.23 -0.03 4.39 1.04 -1.26 -1.29 113.70 115.88 1ce8 s SER 9 Ca -0.21 0.03 0.04 0.00 0.48 0.00 0.00 55.95 56.30 1ce8 s SER 9 Cb 0.07 -1.40 -0.01 0.00 0.10 0.00 0.00 66.02 64.78 1ce8 s SER 9 CO 0.32 0.29 -0.16 -0.63 0.98 0.00 0.00 173.24 174.03 1ce8 s ILE 10 N -1.08 1.32 -0.22 -1.02 1.09 0.22 -1.83 121.20 119.68 1ce8 s ILE 10 Ca 0.19 -0.68 -0.06 0.00 -1.10 0.00 0.00 60.65 59.00 1ce8 s ILE 10 Cb -0.12 -1.12 -0.03 0.00 -1.06 0.00 0.00 42.46 40.13 1ce8 s ILE 10 CO 0.10 0.38 0.04 -0.22 -0.10 0.00 0.00 174.94 175.14 1ce8 s LEU 11 N -0.12 3.45 -0.29 2.97 2.96 0.25 -0.99 118.68 126.91 1ce8 s LEU 11 Ca 0.00 -0.15 -0.06 0.00 -0.22 0.00 0.00 54.13 53.70 1ce8 s LEU 11 Cb -0.09 -1.90 0.01 0.00 0.50 0.00 0.00 46.19 44.71 1ce8 s LEU 11 CO 0.01 0.04 0.07 -0.63 -1.32 0.00 0.00 176.35 174.52 1ce8 s ILE 12 N 1.15 3.85 -0.39 6.68 1.01 0.31 -0.14 121.20 133.66 1ce8 s ILE 12 Ca 0.04 -0.73 -0.29 0.00 0.00 0.00 0.00 60.65 59.67 1ce8 s ILE 12 Cb -0.14 -2.98 0.00 0.00 0.01 0.00 0.00 42.46 39.35 1ce8 s ILE 12 CO 0.03 0.09 1.46 -0.76 0.00 0.00 0.00 174.94 175.76 1ce8 s LEU 13 N 1.48 3.60 0.99 2.97 1.43 -1.05 -2.10 118.68 126.00 1ce8 s LEU 13 Ca 0.02 0.93 -0.13 0.00 -1.03 0.00 0.00 54.13 53.93 1ce8 s LEU 13 Cb -0.17 -3.54 0.19 0.00 0.03 0.00 0.00 46.19 42.70 1ce8 s LEU 13 CO 0.02 -1.44 1.11 -0.83 0.23 0.00 0.00 176.35 175.44 1ce8 s GLY 14 N 4.16 1.57 0.34 -3.19 0.00 0.48 -3.69 107.32 106.98 1ce8 s GLY 14 Ca 0.64 -0.50 0.20 0.00 0.00 0.00 0.00 44.72 45.05 1ce8 s GLY 14 CO 0.32 0.13 1.45 0.00 0.00 0.00 0.00 173.10 175.00 1ce8 h ALA 15 N -1.85 0.81 0.00 3.20 0.00 -1.81 -3.39 119.26 116.22 1ce8 h ALA 15 Ca -0.53 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.16 1ce8 h ALA 15 Cb 1.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1ce8 h ALA 15 CO 0.57 0.29 0.00 0.41 0.00 0.00 0.00 179.25 180.52 1ce8 n GLY 16 N 1.17 -1.77 3.68 0.00 0.00 -1.26 -4.74 105.19 102.27 1ce8 n GLY 16 Ca 0.02 -1.51 -0.41 0.00 0.00 0.00 0.00 46.02 44.12 1ce8 n GLY 16 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ce8 n PRO 17 N 0.00 1.85 -2.08 1.61 -0.04 -1.26 -4.47 135.00 130.60 1ce8 n PRO 17 Ca 0.00 0.65 -0.42 0.00 -0.04 0.00 0.00 63.50 63.69 1ce8 n PRO 17 Cb 0.00 -2.29 -0.03 0.00 -0.04 0.00 0.00 33.50 31.14 1ce8 n PRO 17 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1ce8 s ILE 18 N -1.18 3.12 0.13 0.52 -1.09 -1.26 -4.93 121.20 116.50 1ce8 s ILE 18 Ca 0.60 0.77 -0.01 0.00 -2.23 0.00 0.00 60.65 59.78 1ce8 s ILE 18 Cb -0.54 -3.49 -0.04 0.00 -1.58 0.00 0.00 42.46 36.81 1ce8 s ILE 18 CO 0.59 0.05 0.04 0.68 -1.23 0.00 0.00 174.94 175.06 1ce8 s VAL 19 N 1.37 0.20 0.15 2.92 -7.23 -0.48 -2.59 120.40 114.74 1ce8 s VAL 19 Ca 0.67 -1.91 -0.32 0.00 -1.81 0.00 0.00 61.98 58.61 1ce8 s VAL 19 Cb -0.39 -1.99 -0.12 0.00 0.56 0.00 0.00 36.38 34.45 1ce8 s VAL 19 CO 0.30 -0.53 1.77 -0.38 -0.31 0.00 0.00 175.10 175.95 1ce8 n ILE 20 N -0.09 0.20 -0.10 -0.62 5.41 -1.26 -1.09 119.36 121.81 1ce8 n ILE 20 Ca -0.07 -0.04 0.00 0.00 1.00 0.00 0.00 62.75 63.65 1ce8 n ILE 20 Cb 0.63 -1.99 0.00 0.00 -0.71 0.00 0.00 39.64 37.58 1ce8 n ILE 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ce8 n GLY 21 N 4.04 1.20 2.60 7.39 0.00 -1.26 -4.92 105.19 114.24 1ce8 n GLY 21 Ca 0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 1ce8 n GLY 21 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1ce8 n GLN 22 N -2.00 0.50 0.00 1.61 7.27 -0.25 -4.68 117.38 119.83 1ce8 n GLN 22 Ca 0.00 -2.41 0.00 0.00 0.07 0.00 0.00 57.00 54.66 1ce8 n GLN 22 Cb 0.00 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.15 1ce8 n GLN 22 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1ce8 n ALA 23 N 2.54 0.00 0.31 1.69 0.00 -1.24 -1.39 120.51 122.43 1ce8 n ALA 23 Ca 0.20 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.84 1ce8 n ALA 23 Cb 0.55 0.00 1.06 0.00 0.00 0.00 0.00 19.45 21.06 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 0.00 0.00 0.00 9.09 -1.88 -1.31 114.58 120.48 1ce8 h GLU 25 Ca 0.01 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.42 1ce8 h GLU 25 Cb 0.16 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.26 1ce8 h GLU 25 CO -0.00 0.00 -0.24 0.74 0.05 0.00 0.00 179.01 179.56 1ce8 h PHE 26 N 0.00 0.00 0.20 2.06 0.04 -1.75 -0.56 116.94 116.93 1ce8 h PHE 26 Ca 0.18 0.00 -0.29 0.00 2.80 0.00 0.00 57.97 60.66 1ce8 h PHE 26 Cb 0.98 0.00 0.02 0.00 2.20 0.00 0.00 35.95 39.16 1ce8 h PHE 26 CO 0.00 0.00 -1.33 0.22 -0.60 0.00 0.00 178.31 176.60 1ce8 h ASP 27 N 0.00 0.65 0.52 2.17 3.58 -1.47 -0.45 116.42 121.43 1ce8 h ASP 27 Ca 0.00 -0.93 -0.02 0.00 0.42 0.00 0.00 57.03 56.51 1ce8 h ASP 27 Cb 0.92 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 41.75 1ce8 h ASP 27 CO 0.00 1.63 -0.41 0.22 -2.88 0.00 0.00 179.24 177.80 1ce8 h TYR 28 N -0.06 -1.10 -0.22 0.28 3.20 -1.44 0.35 116.97 117.97 1ce8 h TYR 28 Ca -0.25 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.62 1ce8 h TYR 28 Cb 1.96 0.41 -0.01 0.00 1.54 0.00 0.00 36.73 40.64 1ce8 h TYR 28 CO 0.14 -0.59 0.11 0.77 -1.64 0.00 0.00 178.16 176.96 1ce8 h SER 29 N -0.91 0.28 -0.93 -2.11 0.02 -1.21 -2.11 113.55 106.59 1ce8 h SER 29 Ca -0.06 -0.11 0.07 0.00 -0.84 0.00 0.00 61.79 60.85 1ce8 h SER 29 Cb 0.77 -0.07 -0.07 0.00 0.14 0.00 0.00 62.40 63.17 1ce8 h SER 29 CO -0.00 0.32 0.58 1.23 -1.14 0.00 0.00 176.83 177.82 1ce8 h GLY 30 N 0.23 1.43 1.42 -3.77 0.00 -0.89 -0.39 103.07 101.10 1ce8 h GLY 30 Ca 0.08 -0.42 -0.17 0.00 0.00 0.00 0.00 47.33 46.82 1ce8 h GLY 30 CO -0.01 0.26 -0.56 0.00 0.00 0.00 0.00 176.54 176.23 1ce8 h ALA 31 N 1.45 0.65 -0.63 3.60 0.00 -0.17 -2.29 119.26 121.87 1ce8 h ALA 31 Ca 0.42 -0.52 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1ce8 h ALA 31 Cb 0.23 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1ce8 h ALA 31 CO -0.19 0.69 0.19 1.96 0.00 0.00 0.00 179.25 181.89 1ce8 h GLN 32 N 0.47 0.99 -0.52 0.00 4.20 -0.71 -0.29 115.11 119.23 1ce8 h GLN 32 Ca 0.01 -0.22 -0.09 0.00 0.06 0.00 0.00 58.65 58.41 1ce8 h GLN 32 Cb 1.11 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.73 1ce8 h GLN 32 CO 0.11 0.88 -0.04 0.00 -0.67 0.00 0.00 178.83 179.10 1ce8 h ALA 33 N 1.07 0.93 -0.23 3.87 0.00 -1.01 -0.28 119.26 123.60 1ce8 h ALA 33 Ca 0.20 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1ce8 h ALA 33 Cb 0.31 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1ce8 h ALA 33 CO -0.00 0.63 -0.10 0.00 0.00 0.00 0.00 179.25 179.78 1ce8 h LYS 35 N 0.20 0.48 -0.07 0.00 3.64 -0.94 -0.27 116.57 119.61 1ce8 h LYS 35 Ca 0.05 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1ce8 h LYS 35 Cb 0.58 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1ce8 h LYS 35 CO 0.03 0.32 0.04 0.00 -2.27 0.00 0.00 179.45 177.57 1ce8 h ALA 36 N 1.17 0.09 -0.19 5.00 0.00 -1.03 -1.53 119.26 122.77 1ce8 h ALA 36 Ca 0.15 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 1ce8 h ALA 36 Cb -0.02 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1ce8 h ALA 36 CO -0.06 -0.36 -0.34 -0.07 0.00 0.00 0.00 179.25 178.41 1ce8 h LEU 37 N 0.01 0.40 -0.07 0.00 3.38 -1.29 -2.37 115.31 115.37 1ce8 h LEU 37 Ca 0.02 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 1ce8 h LEU 37 Cb 0.10 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1ce8 h LEU 37 CO -0.00 0.72 -0.18 -0.09 0.09 0.00 0.00 178.44 178.98 1ce8 h ARG 38 N 0.33 0.24 -0.75 1.13 2.43 -1.04 0.23 114.38 116.95 1ce8 h ARG 38 Ca 0.04 -0.17 0.17 0.00 -0.81 0.00 0.00 59.98 59.21 1ce8 h ARG 38 Cb 0.76 0.03 -0.12 0.00 -0.42 0.00 0.00 29.97 30.22 1ce8 h ARG 38 CO 0.06 0.78 0.08 0.93 -1.51 0.00 0.00 179.97 180.31 1ce8 h GLU 39 N -0.26 0.15 -0.39 0.20 5.08 -1.17 0.12 114.58 118.31 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 0.79 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1ce8 h GLU 39 CO 0.04 0.10 0.00 0.39 -1.00 0.00 0.00 179.01 178.54 1ce8 n GLU 40 N -5.28 1.26 -1.11 2.33 -0.58 -0.90 -4.89 120.64 111.46 1ce8 n GLU 40 Ca 0.14 -0.29 -0.04 0.00 -0.42 0.00 0.00 57.16 56.55 1ce8 n GLU 40 Cb 0.48 -1.24 -0.02 0.00 -0.57 0.00 0.00 31.44 30.09 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 0.42 0.68 3.91 0.62 0.00 0.41 -5.04 105.19 106.20 1ce8 n GLY 41 Ca 0.03 -0.77 -0.27 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.12 3.47 -0.34 1.61 1.51 0.81 -5.01 117.35 117.29 1ce8 s TYR 42 Ca 0.00 0.71 -0.18 0.00 -1.01 0.00 0.00 57.07 56.60 1ce8 s TYR 42 Cb 0.00 -2.37 -0.01 0.00 -0.11 0.00 0.00 41.96 39.47 1ce8 s TYR 42 CO 0.00 -0.37 0.49 0.50 -1.11 0.00 0.00 175.55 175.05 1ce8 s ARG 43 N -4.76 3.66 -0.21 -0.62 3.52 -0.41 -4.45 118.95 115.68 1ce8 s ARG 43 Ca 0.48 -0.16 -0.09 0.00 -0.13 0.00 0.00 55.73 55.84 1ce8 s ARG 43 Cb -0.10 -3.79 -0.05 0.00 -1.56 0.00 0.00 34.95 29.45 1ce8 s ARG 43 CO 0.44 -0.59 0.11 0.08 -0.81 0.00 0.00 175.30 174.53 1ce8 s VAL 44 N 2.32 5.12 -0.08 7.11 1.01 -1.26 0.70 120.40 135.33 1ce8 s VAL 44 Ca 0.18 0.09 0.04 0.00 0.00 0.00 0.00 61.98 62.28 1ce8 s VAL 44 Cb -0.16 -3.35 0.00 0.00 0.00 0.00 0.00 36.38 32.88 1ce8 s VAL 44 CO 0.13 0.41 -0.20 -0.63 0.00 0.00 0.00 175.10 174.81 1ce8 s ILE 45 N 0.66 1.72 0.03 2.22 1.01 -0.17 -0.68 121.20 126.00 1ce8 s ILE 45 Ca 0.06 -0.84 -0.07 0.00 0.00 0.00 0.00 60.65 59.80 1ce8 s ILE 45 Cb -0.12 -1.50 -0.00 0.00 0.01 0.00 0.00 42.46 40.84 1ce8 s ILE 45 CO 0.01 0.49 0.13 0.54 0.00 0.00 0.00 174.94 176.11 1ce8 s ASN 46 N 0.34 0.11 -0.07 3.58 4.22 0.25 0.11 114.94 123.49 1ce8 s ASN 46 Ca -0.14 -0.44 0.03 0.00 -2.14 0.00 0.00 52.86 50.17 1ce8 s ASN 46 Cb -0.16 0.24 0.01 0.00 1.28 0.00 0.00 41.25 42.62 1ce8 s ASN 46 CO 0.06 -0.51 -0.17 0.54 -2.04 0.00 0.00 177.10 174.98 1ce8 s VAL 47 N -2.46 1.48 -0.30 3.54 0.11 -0.89 0.34 120.40 122.22 1ce8 s VAL 47 Ca -0.06 -0.70 -0.08 0.00 -2.93 0.00 0.00 61.98 58.21 1ce8 s VAL 47 Cb -0.02 -1.31 0.15 0.00 -1.53 0.00 0.00 36.38 33.67 1ce8 s VAL 47 CO -0.04 0.43 0.65 0.21 -3.33 0.00 0.00 175.10 173.03 1ce8 s ASN 48 N 0.41 -1.18 0.55 3.54 3.84 -0.14 0.18 114.94 122.14 1ce8 s ASN 48 Ca -0.13 1.38 0.33 0.00 0.21 0.00 0.00 52.86 54.65 1ce8 s ASN 48 Cb -0.15 2.25 1.32 0.00 -0.55 0.00 0.00 41.25 44.12 1ce8 s ASN 48 CO 0.05 -0.22 1.97 0.77 -2.79 0.00 0.00 177.10 176.87 1ce8 h SER 49 N 7.98 0.00 -3.39 -4.21 4.64 -1.80 -3.36 113.55 113.41 1ce8 h SER 49 Ca -0.19 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.56 1ce8 h SER 49 Cb 1.12 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.14 1ce8 h SER 49 CO 0.14 0.00 0.91 0.21 -0.87 0.00 0.00 176.83 177.21 1ce8 s ASN 50 N -5.70 6.76 0.37 4.97 2.47 -1.26 -1.22 114.94 121.33 1ce8 s ASN 50 Ca 0.01 0.90 0.20 0.00 0.42 0.00 0.00 52.86 54.39 1ce8 s ASN 50 Cb 0.09 -2.54 0.38 0.00 -1.45 0.00 0.00 41.25 37.73 1ce8 s ASN 50 CO 0.55 -1.06 1.60 1.55 -3.72 0.00 0.00 177.10 176.01 1ce8 h PRO 51 N 8.82 0.00 -1.77 0.43 0.13 -1.83 -3.33 132.00 134.46 1ce8 h PRO 51 Ca -0.23 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.69 1ce8 h PRO 51 Cb 1.07 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.11 1ce8 h PRO 51 CO 1.06 0.28 0.20 0.00 -0.23 0.00 0.00 178.00 179.31 1ce8 n ALA 52 N -2.18 4.95 -2.88 -0.56 0.00 -1.26 -4.66 120.51 113.91 1ce8 n ALA 52 Ca 0.02 -1.21 -0.26 0.00 0.00 0.00 0.00 53.44 51.99 1ce8 n ALA 52 Cb 0.59 -1.39 -0.16 0.00 0.00 0.00 0.00 19.45 18.50 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 -1.21 1.47 0.34 0.00 -4.23 -1.25 -4.58 115.64 106.17 1ce8 s THR 53 Ca 0.25 -0.74 0.06 0.00 -1.18 0.00 0.00 61.69 60.09 1ce8 s THR 53 Cb 0.18 -1.26 0.12 0.00 1.34 0.00 0.00 72.50 72.88 1ce8 s THR 53 CO -0.02 0.42 1.83 0.40 -0.54 0.00 0.00 174.62 176.71 1ce8 h ILE 54 N 5.23 1.22 -0.00 2.99 1.08 -1.89 -1.94 117.51 124.20 1ce8 h ILE 54 Ca -0.33 -1.01 0.00 0.00 -0.39 0.00 0.00 64.86 63.14 1ce8 h ILE 54 Cb 1.17 1.25 -0.00 0.00 -3.07 0.00 0.00 36.82 36.17 1ce8 h ILE 54 CO 0.48 0.32 0.04 -0.03 -0.69 0.00 0.00 178.15 178.27 1ce8 h MET 55 N 0.34 0.00 -0.33 2.37 1.85 -1.92 -0.34 114.93 116.89 1ce8 h MET 55 Ca 0.06 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.15 1ce8 h MET 55 Cb 0.50 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.53 1ce8 h MET 55 CO 0.03 0.00 0.00 0.25 -0.40 0.00 0.00 176.91 176.79 1ce8 n THR 56 N -3.07 0.43 -2.35 -0.77 -2.24 -0.73 -4.82 114.28 100.73 1ce8 n THR 56 Ca -0.03 -0.61 -0.42 0.00 -2.27 0.00 0.00 64.05 60.71 1ce8 n THR 56 Cb 0.11 0.73 -0.03 0.00 -2.10 0.00 0.00 70.33 69.04 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 -1.47 6.98 0.49 3.42 1.01 -0.14 -4.88 116.67 122.09 1ce8 s ASP 57 Ca 0.36 2.02 0.29 0.00 0.71 0.00 0.00 52.55 55.93 1ce8 s ASP 57 Cb 0.21 -2.57 1.38 0.00 1.01 0.00 0.00 42.92 42.95 1ce8 s ASP 57 CO 0.29 -0.59 1.82 1.55 0.21 0.00 0.00 175.17 178.45 1ce8 h PRO 58 N 7.27 0.13 0.00 8.23 0.14 -1.89 0.18 132.00 146.06 1ce8 h PRO 58 Ca -0.39 -0.01 0.00 0.00 0.14 0.00 0.00 66.00 65.75 1ce8 h PRO 58 Cb 1.19 -0.03 0.00 0.00 0.14 0.00 0.00 31.00 32.30 1ce8 h PRO 58 CO 0.86 0.09 0.00 -0.85 0.14 0.00 0.00 178.00 178.24 1ce8 n GLU 59 N -4.35 0.09 0.03 0.86 0.00 -1.26 -3.48 120.64 112.54 1ce8 n GLU 59 Ca 0.23 0.01 0.12 0.00 0.00 0.00 0.00 57.16 57.52 1ce8 n GLU 59 Cb 1.04 -1.50 0.18 0.00 0.00 0.00 0.00 31.44 31.16 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 -1.45 0.18 -4.03 3.44 2.81 0.65 -4.97 117.12 113.75 1ce8 n MET 60 Ca 0.08 0.04 -0.10 0.00 -1.81 0.00 0.00 57.70 55.91 1ce8 n MET 60 Cb 0.31 -1.60 -0.05 0.00 -0.71 0.00 0.00 33.22 31.17 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 -3.11 0.06 -0.05 3.04 0.00 -1.23 -4.60 121.76 115.88 1ce8 s ALA 61 Ca 0.08 -1.07 -0.10 0.00 0.00 0.00 0.00 51.96 50.87 1ce8 s ALA 61 Cb 0.15 1.10 -0.30 0.00 0.00 0.00 0.00 23.12 24.07 1ce8 s ALA 61 CO 0.72 -0.83 0.65 -0.44 0.00 0.00 0.00 175.76 175.87 1ce8 h ASP 62 N 2.25 0.58 -2.82 0.00 3.32 -1.17 -3.44 116.42 115.14 1ce8 h ASP 62 Ca -0.28 -0.90 -0.48 0.00 0.02 0.00 0.00 57.03 55.39 1ce8 h ASP 62 Cb 1.25 -0.19 -0.40 0.00 0.22 0.00 0.00 39.33 40.21 1ce8 h ASP 62 CO 0.38 1.77 -0.75 0.00 -1.72 0.00 0.00 179.24 178.91 1ce8 s ALA 63 N -2.58 0.44 -0.24 3.45 0.00 -0.36 -4.92 121.76 117.55 1ce8 s ALA 63 Ca -0.16 -0.70 -0.10 0.00 0.00 0.00 0.00 51.96 50.99 1ce8 s ALA 63 Cb 0.06 -1.29 -0.05 0.00 0.00 0.00 0.00 23.12 21.84 1ce8 s ALA 63 CO 0.85 -1.47 0.16 0.99 0.00 0.00 0.00 175.76 176.29 1ce8 s THR 64 N 2.14 5.33 -0.24 0.00 2.01 -1.26 -0.58 115.64 123.04 1ce8 s THR 64 Ca 0.07 0.17 0.02 0.00 0.31 0.00 0.00 61.69 62.26 1ce8 s THR 64 Cb -0.16 -3.49 0.05 0.00 0.01 0.00 0.00 72.50 68.92 1ce8 s THR 64 CO -0.26 0.34 -0.12 -0.31 -0.69 0.00 0.00 174.62 173.58 1ce8 s TYR 65 N 1.09 3.10 -1.04 4.92 2.02 0.15 -0.87 117.35 126.72 1ce8 s TYR 65 Ca 0.07 -2.15 -0.13 0.00 -0.37 0.00 0.00 57.07 54.50 1ce8 s TYR 65 Cb -0.14 -1.90 0.22 0.00 -0.40 0.00 0.00 41.96 39.75 1ce8 s TYR 65 CO 0.05 -0.86 1.10 0.42 -1.57 0.00 0.00 175.55 174.69 1ce8 s ILE 66 N 1.16 5.53 0.05 2.71 1.01 -1.26 -0.97 121.20 129.43 1ce8 s ILE 66 Ca -0.06 -2.77 -0.02 0.00 0.00 0.00 0.00 60.65 57.80 1ce8 s ILE 66 Cb -0.19 -4.66 -0.03 0.00 0.01 0.00 0.00 42.46 37.59 1ce8 s ILE 66 CO -0.07 -1.29 0.01 -1.61 0.00 0.00 0.00 174.94 171.99 1ce8 s GLU 67 N 0.25 0.58 0.13 2.79 0.41 -1.26 -4.53 118.70 117.06 1ce8 s GLU 67 Ca 0.30 -1.00 -0.34 0.00 -0.41 0.00 0.00 54.97 53.52 1ce8 s GLU 67 Cb -0.08 0.21 -0.13 0.00 -1.78 0.00 0.00 34.13 32.35 1ce8 s GLU 67 CO -0.07 -0.12 1.63 -2.30 -0.49 0.00 0.00 175.26 173.91 1ce8 n PRO 68 N 0.48 2.20 -1.20 0.39 -0.01 -1.26 -3.44 135.00 132.16 1ce8 n PRO 68 Ca -0.17 0.80 -0.36 0.00 -0.01 0.00 0.00 63.50 63.76 1ce8 n PRO 68 Cb 0.60 -2.58 -0.03 0.00 -0.01 0.00 0.00 33.50 31.47 1ce8 n PRO 68 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 175.50 174.60 1ce8 n ILE 69 N 3.71 2.78 -5.14 4.25 5.41 -1.26 -4.62 119.36 124.49 1ce8 n ILE 69 Ca 0.18 -2.04 -0.29 0.00 1.00 0.00 0.00 62.75 61.59 1ce8 n ILE 69 Cb 0.29 -2.38 -0.16 0.00 -0.71 0.00 0.00 39.64 36.68 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 3.68 2.15 0.31 1.39 2.46 -1.26 -5.03 115.29 118.99 1ce8 s HIS 70 Ca 0.52 -0.53 0.08 0.00 0.47 0.00 0.00 55.06 55.59 1ce8 s HIS 70 Cb 0.14 -1.40 0.81 0.00 -0.13 0.00 0.00 32.58 31.99 1ce8 s HIS 70 CO -0.00 -0.13 1.76 0.11 -2.47 0.00 0.00 174.74 174.01 1ce8 h TRP 71 N 5.87 1.04 -0.15 3.88 5.08 -1.91 0.22 115.95 129.97 1ce8 h TRP 71 Ca -0.36 0.03 -0.06 0.00 1.08 0.00 0.00 58.89 59.58 1ce8 h TRP 71 Cb 1.15 -0.31 -0.01 0.00 -3.00 0.00 0.00 29.16 26.99 1ce8 h TRP 71 CO 0.41 0.17 -0.18 0.93 -1.28 0.00 0.00 178.44 178.49 1ce8 h GLU 72 N 0.69 0.25 0.03 0.12 5.08 -1.96 0.52 114.58 119.31 1ce8 h GLU 72 Ca 0.60 -0.07 -0.27 0.00 -1.00 0.00 0.00 59.36 58.62 1ce8 h GLU 72 Cb 1.04 -0.03 0.02 0.00 0.50 0.00 0.00 28.75 30.28 1ce8 h GLU 72 CO -0.41 0.44 -1.09 0.28 -1.00 0.00 0.00 179.01 177.23 1ce8 h VAL 73 N 0.23 1.29 -0.61 3.13 2.07 -1.00 -3.01 116.25 118.37 1ce8 h VAL 73 Ca 0.04 -2.32 -0.09 0.00 0.82 0.00 0.00 66.70 65.15 1ce8 h VAL 73 Cb 0.47 2.46 -0.02 0.00 -1.52 0.00 0.00 31.29 32.67 1ce8 h VAL 73 CO 0.03 0.71 0.02 0.58 0.02 0.00 0.00 177.57 178.94 1ce8 h VAL 74 N 0.35 1.26 -0.55 2.57 2.07 -0.13 -2.55 116.25 119.27 1ce8 h VAL 74 Ca -0.14 -1.11 0.08 0.00 0.82 0.00 0.00 66.70 66.35 1ce8 h VAL 74 Cb 1.74 0.77 -0.07 0.00 -1.52 0.00 0.00 31.29 32.21 1ce8 h VAL 74 CO 0.21 0.41 0.18 -0.09 0.02 0.00 0.00 177.57 178.30 1ce8 h ARG 75 N 0.96 0.34 -0.92 1.57 2.43 0.01 0.16 114.38 118.93 1ce8 h ARG 75 Ca 0.18 -0.02 0.12 0.00 -0.81 0.00 0.00 59.98 59.44 1ce8 h ARG 75 Cb 0.52 -0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 29.92 1ce8 h ARG 75 CO 0.03 0.23 0.59 0.87 -1.51 0.00 0.00 179.97 180.17 1ce8 h LYS 76 N 0.35 0.84 -0.24 0.20 1.79 -1.36 0.90 116.57 119.05 1ce8 h LYS 76 Ca 0.27 -0.05 -0.14 0.00 -2.18 0.00 0.00 60.65 58.56 1ce8 h LYS 76 Cb 0.33 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 30.78 1ce8 h LYS 76 CO -0.29 0.56 -0.41 0.82 -1.08 0.00 0.00 179.45 179.04 1ce8 h ILE 77 N 0.87 1.30 -0.19 1.86 2.04 -0.35 -2.60 117.51 120.44 1ce8 h ILE 77 Ca 0.45 -1.59 -0.06 0.00 1.00 0.00 0.00 64.86 64.66 1ce8 h ILE 77 Cb 0.51 1.56 -0.00 0.00 -0.74 0.00 0.00 36.82 38.15 1ce8 h ILE 77 CO -0.21 0.50 -0.10 0.40 0.00 0.00 0.00 178.15 178.74 1ce8 h ILE 78 N 0.47 1.31 -1.01 -0.67 2.04 0.50 0.22 117.51 120.37 1ce8 h ILE 78 Ca 0.04 -1.18 0.05 0.00 1.00 0.00 0.00 64.86 64.77 1ce8 h ILE 78 Cb 0.92 1.67 -0.06 0.00 -0.74 0.00 0.00 36.82 38.61 1ce8 h ILE 78 CO 0.08 0.35 0.65 -0.08 0.00 0.00 0.00 178.15 179.16 1ce8 h GLU 79 N 0.10 1.19 0.19 2.37 4.81 -0.88 0.82 114.58 123.17 1ce8 h GLU 79 Ca 0.04 -0.07 -0.32 0.00 -0.13 0.00 0.00 59.36 58.88 1ce8 h GLU 79 Cb 0.60 -0.27 0.02 0.00 0.63 0.00 0.00 28.75 29.73 1ce8 h GLU 79 CO 0.03 0.79 -1.47 -0.22 -0.73 0.00 0.00 179.01 177.41 1ce8 h LYS 80 N 1.22 0.41 0.00 1.92 3.64 -1.35 -3.36 116.57 119.05 1ce8 h LYS 80 Ca 0.42 -0.70 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 1ce8 h LYS 80 Cb 0.09 0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 1ce8 h LYS 80 CO -0.15 1.32 -1.49 0.39 -2.27 0.00 0.00 179.45 177.25 1ce8 n GLU 81 N -3.61 0.45 -3.97 1.90 -0.58 0.75 -5.00 120.64 110.58 1ce8 n GLU 81 Ca -0.16 -0.09 -0.33 0.00 -0.42 0.00 0.00 57.16 56.17 1ce8 n GLU 81 Cb 1.07 -1.56 -0.01 0.00 -0.57 0.00 0.00 31.44 30.37 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 -2.10 -1.67 -2.07 3.49 5.12 0.28 -4.91 116.66 114.81 1ce8 n ARG 82 Ca -0.01 0.29 -0.40 0.00 -1.93 0.00 0.00 57.85 55.80 1ce8 n ARG 82 Cb 0.49 -3.82 -0.01 0.00 -1.16 0.00 0.00 32.46 27.96 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 -6.73 4.24 0.19 5.56 0.04 -1.26 -4.89 135.00 132.14 1ce8 s PRO 83 Ca 0.24 2.24 0.01 0.00 0.04 0.00 0.00 61.00 63.53 1ce8 s PRO 83 Cb -0.11 -2.98 0.09 0.00 0.04 0.00 0.00 34.50 31.54 1ce8 s PRO 83 CO 0.92 -0.30 1.45 -0.44 0.04 0.00 0.00 177.00 178.67 1ce8 h ASP 84 N 3.17 0.36 -5.26 6.66 3.32 -1.68 -3.42 116.42 119.57 1ce8 h ASP 84 Ca -0.49 -0.24 -0.12 0.00 0.02 0.00 0.00 57.03 56.19 1ce8 h ASP 84 Cb 1.23 -0.11 -0.14 0.00 0.22 0.00 0.00 39.33 40.53 1ce8 h ASP 84 CO 0.65 0.98 -0.51 0.00 -1.72 0.00 0.00 179.24 178.63 1ce8 s ALA 85 N -3.54 0.28 -0.10 3.45 0.00 -1.06 0.52 121.76 121.30 1ce8 s ALA 85 Ca -0.04 -1.04 0.02 0.00 0.00 0.00 0.00 51.96 50.90 1ce8 s ALA 85 Cb 0.11 0.59 0.01 0.00 0.00 0.00 0.00 23.12 23.83 1ce8 s ALA 85 CO 0.83 -0.49 -0.16 0.54 0.00 0.00 0.00 175.76 176.47 1ce8 s VAL 86 N -3.94 1.54 -0.33 0.00 0.11 0.20 0.88 120.40 118.86 1ce8 s VAL 86 Ca 0.12 -0.68 -0.11 0.00 -2.93 0.00 0.00 61.98 58.38 1ce8 s VAL 86 Cb 0.06 -1.39 -0.00 0.00 -1.53 0.00 0.00 36.38 33.51 1ce8 s VAL 86 CO -0.06 0.45 0.19 -0.22 -3.33 0.00 0.00 175.10 172.13 1ce8 s LEU 87 N 0.85 4.35 -0.08 2.54 2.96 0.80 -1.49 118.68 128.60 1ce8 s LEU 87 Ca -0.09 -0.57 0.13 0.00 -0.22 0.00 0.00 54.13 53.37 1ce8 s LEU 87 Cb -0.15 -2.05 0.36 0.00 0.50 0.00 0.00 46.19 44.84 1ce8 s LEU 87 CO 0.01 -0.24 1.28 -0.81 -1.32 0.00 0.00 176.35 175.27 1ce8 n PRO 88 N 5.03 2.77 0.00 0.98 -0.04 -1.26 -2.53 135.00 139.94 1ce8 n PRO 88 Ca -0.13 -2.34 0.12 0.00 -0.04 0.00 0.00 63.50 61.11 1ce8 n PRO 88 Cb 0.49 -1.48 0.17 0.00 -0.04 0.00 0.00 33.50 32.64 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 -0.16 0.00 -0.13 0.52 -2.24 -1.26 -3.74 114.28 107.27 1ce8 n THR 89 Ca 0.14 -0.44 0.12 0.00 -2.27 0.00 0.00 64.05 61.60 1ce8 n THR 89 Cb 0.61 1.30 0.28 0.00 -2.10 0.00 0.00 70.33 70.42 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 1.05 2.65 -2.70 -0.78 2.81 -1.26 -2.34 117.12 116.55 1ce8 n MET 90 Ca 0.15 -2.53 -0.16 0.00 -1.81 0.00 0.00 57.70 53.35 1ce8 n MET 90 Cb 0.55 -1.55 0.01 0.00 -0.71 0.00 0.00 33.22 31.52 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 1.59 3.11 7.00 3.03 0.00 -1.24 -4.12 105.19 114.56 1ce8 n GLY 91 Ca 0.23 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.46 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 -0.13 1.00 0.19 -0.02 0.00 -1.26 -1.05 105.19 103.92 1ce8 n GLY 92 Ca 0.20 -0.59 0.07 0.00 0.00 0.00 0.00 46.02 45.69 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 0.00 -0.50 1.61 5.75 -1.95 -3.04 115.11 116.98 1ce8 h GLN 93 Ca 0.00 0.00 -0.08 0.00 -0.15 0.00 0.00 58.65 58.42 1ce8 h GLN 93 Cb 0.00 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.53 1ce8 h GLN 93 CO 0.00 0.34 -0.01 1.15 -2.65 0.00 0.00 178.83 177.66 1ce8 h THR 94 N 0.00 1.25 -0.12 2.39 2.02 -1.82 -1.63 112.91 115.00 1ce8 h THR 94 Ca -0.00 -1.05 -0.07 0.00 0.77 0.00 0.00 66.41 66.05 1ce8 h THR 94 Cb 0.94 0.87 0.00 0.00 -1.74 0.00 0.00 68.15 68.22 1ce8 h THR 94 CO 0.04 0.37 -0.21 0.00 0.37 0.00 0.00 175.52 176.09 1ce8 h ALA 95 N 1.20 0.19 -0.77 6.16 0.00 -0.98 -2.65 119.26 122.40 1ce8 h ALA 95 Ca 0.15 -0.37 0.06 0.00 0.00 0.00 0.00 54.91 54.75 1ce8 h ALA 95 Cb 0.48 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 1ce8 h ALA 95 CO 0.02 0.14 0.46 -0.07 0.00 0.00 0.00 179.25 179.80 1ce8 h LEU 96 N -0.07 0.70 -0.39 0.00 3.38 -1.46 -1.48 115.31 116.00 1ce8 h LEU 96 Ca 0.01 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1ce8 h LEU 96 Cb 0.79 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1ce8 h LEU 96 CO 0.05 0.45 0.04 0.78 0.09 0.00 0.00 178.44 179.84 1ce8 h ASN 97 N 0.83 0.64 -0.13 -0.43 4.21 -1.30 -2.19 115.58 117.21 1ce8 h ASN 97 Ca 0.34 -0.28 -0.02 0.00 1.21 0.00 0.00 56.30 57.55 1ce8 h ASN 97 Cb 0.19 -0.17 -0.00 0.00 -1.12 0.00 0.00 38.32 37.21 1ce8 h ASN 97 CO -0.18 0.76 0.01 0.00 -1.29 0.00 0.00 177.43 176.73 1ce8 h ALA 99 N 0.77 0.26 0.00 0.00 0.00 -1.29 0.48 119.26 119.48 1ce8 h ALA 99 Ca 0.04 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1ce8 h ALA 99 Cb 0.34 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1ce8 h ALA 99 CO 0.01 -0.35 -0.05 -0.07 0.00 0.00 0.00 179.25 178.79 1ce8 h LEU 100 N 0.17 0.00 0.04 0.00 4.07 -1.25 -1.41 115.31 116.93 1ce8 h LEU 100 Ca 0.11 0.00 -0.22 0.00 0.08 0.00 0.00 57.88 57.84 1ce8 h LEU 100 Cb 0.09 0.00 0.02 0.00 1.08 0.00 0.00 40.66 41.85 1ce8 h LEU 100 CO -0.12 0.05 -0.90 -0.08 -1.08 0.00 0.00 178.44 176.31 1ce8 h GLU 101 N 0.00 0.54 -0.79 1.13 4.57 -0.32 -1.45 114.58 118.27 1ce8 h GLU 101 Ca -0.00 -0.63 0.06 0.00 -1.18 0.00 0.00 59.36 57.61 1ce8 h GLU 101 Cb 0.10 0.19 -0.05 0.00 -0.16 0.00 0.00 28.75 28.83 1ce8 h GLU 101 CO 0.01 1.25 0.51 -0.07 -1.18 0.00 0.00 179.01 179.53 1ce8 h LEU 102 N 0.11 0.76 0.70 1.64 3.38 0.80 -0.56 115.31 122.14 1ce8 h LEU 102 Ca -0.12 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 1ce8 h LEU 102 Cb 1.60 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 42.19 1ce8 h LEU 102 CO 0.18 0.49 -0.34 -0.08 0.09 0.00 0.00 178.44 178.78 1ce8 h GLU 103 N 0.86 -0.90 -0.78 1.13 4.57 -1.26 0.23 114.58 118.43 1ce8 h GLU 103 Ca 0.34 0.06 0.22 0.00 -1.18 0.00 0.00 59.36 58.80 1ce8 h GLU 103 Cb 0.21 0.21 -0.03 0.00 -0.16 0.00 0.00 28.75 28.98 1ce8 h GLU 103 CO -0.11 -0.60 0.56 -0.09 -1.18 0.00 0.00 179.01 177.58 1ce8 h ARG 104 N -1.08 0.01 -0.01 1.92 2.43 -1.01 0.48 114.38 117.12 1ce8 h ARG 104 Ca -0.10 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1ce8 h ARG 104 Cb 0.72 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 1ce8 h ARG 104 CO 0.16 0.01 -0.09 1.04 -1.51 0.00 0.00 179.97 179.57 1ce8 n GLN 105 N -4.31 1.30 -1.01 0.20 1.13 -0.24 -4.92 117.38 109.53 1ce8 n GLN 105 Ca 0.16 -0.73 -0.00 0.00 -1.94 0.00 0.00 57.00 54.49 1ce8 n GLN 105 Cb 0.84 -1.48 -0.00 0.00 0.11 0.00 0.00 30.24 29.70 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 1.23 0.43 0.31 1.08 0.00 0.17 -4.90 105.19 103.51 1ce8 n GLY 106 Ca 0.17 -0.08 -0.02 0.00 0.00 0.00 0.00 46.02 46.09 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 1.21 0.04 1.61 2.07 -0.74 0.20 116.25 120.65 1ce8 h VAL 107 Ca -0.01 -0.67 -0.00 0.00 0.82 0.00 0.00 66.70 66.84 1ce8 h VAL 107 Cb 0.19 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1ce8 h VAL 107 CO 0.01 0.26 -0.02 -0.07 0.02 0.00 0.00 177.57 177.77 1ce8 h LEU 108 N 0.82 -0.05 -0.38 2.57 3.38 -1.83 -2.16 115.31 117.66 1ce8 h LEU 108 Ca 0.19 -0.37 0.04 0.00 0.09 0.00 0.00 57.88 57.84 1ce8 h LEU 108 Cb 0.18 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 1ce8 h LEU 108 CO -0.02 0.35 0.15 -0.08 0.09 0.00 0.00 178.44 178.93 1ce8 h GLU 109 N -0.46 0.31 -0.89 1.13 4.57 -1.83 0.57 114.58 117.98 1ce8 h GLU 109 Ca -0.01 -0.02 0.16 0.00 -1.18 0.00 0.00 59.36 58.32 1ce8 h GLU 109 Cb 0.41 -0.07 -0.07 0.00 -0.16 0.00 0.00 28.75 28.87 1ce8 h GLU 109 CO 0.01 0.20 0.57 1.49 -1.18 0.00 0.00 179.01 180.11 1ce8 h GLU 110 N 0.32 0.59 -0.03 1.92 4.81 -0.52 -2.31 114.58 119.35 1ce8 h GLU 110 Ca 0.17 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1ce8 h GLU 110 Cb 0.13 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1ce8 h GLU 110 CO -0.16 0.39 0.00 1.19 -0.73 0.00 0.00 179.01 179.70 1ce8 n PHE 111 N -4.55 0.10 -3.75 0.92 3.72 -0.55 -4.98 117.46 108.37 1ce8 n PHE 111 Ca 0.18 -0.91 -0.23 0.00 -0.05 0.00 0.00 57.45 56.44 1ce8 n PHE 111 Cb 0.53 -0.15 0.02 0.00 -0.94 0.00 0.00 39.48 38.94 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 -1.19 -0.34 3.67 1.37 0.00 0.18 -4.90 105.19 103.97 1ce8 n GLY 112 Ca 0.14 0.16 -0.38 0.00 0.00 0.00 0.00 46.02 45.94 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 -3.72 5.17 -0.19 1.61 1.01 -0.07 -4.80 120.40 119.42 1ce8 s VAL 113 Ca 0.04 0.78 -0.19 0.00 0.00 0.00 0.00 61.98 62.61 1ce8 s VAL 113 Cb -0.01 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.57 1ce8 s VAL 113 CO 0.83 0.23 0.55 -0.89 0.00 0.00 0.00 175.10 175.82 1ce8 s THR 114 N 1.40 5.09 -0.48 3.92 2.01 0.18 -4.78 115.64 122.98 1ce8 s THR 114 Ca 0.21 1.04 -0.28 0.00 0.31 0.00 0.00 61.69 62.96 1ce8 s THR 114 Cb -0.15 -3.87 0.03 0.00 0.01 0.00 0.00 72.50 68.51 1ce8 s THR 114 CO 0.09 0.17 1.09 -0.32 -0.69 0.00 0.00 174.62 174.96 1ce8 s MET 115 N 1.60 3.67 0.41 4.92 1.75 -1.26 0.60 119.30 130.99 1ce8 s MET 115 Ca 0.26 0.46 0.08 0.00 -1.25 0.00 0.00 55.69 55.24 1ce8 s MET 115 Cb -0.16 -3.91 -0.03 0.00 2.84 0.00 0.00 34.83 33.57 1ce8 s MET 115 CO 0.10 -1.35 0.34 0.96 -0.65 0.00 0.00 175.02 174.42 1ce8 s ILE 116 N 4.30 2.71 0.00 10.11 -4.36 -0.55 -4.63 121.20 128.77 1ce8 s ILE 116 Ca 0.45 -1.40 0.00 0.00 -0.26 0.00 0.00 60.65 59.44 1ce8 s ILE 116 Cb -0.08 -3.02 0.00 0.00 1.25 0.00 0.00 42.46 40.62 1ce8 s ILE 116 CO 0.31 -0.02 0.00 0.61 0.24 0.00 0.00 174.94 176.07 1ce8 n GLY 117 N -1.48 2.03 3.13 6.27 0.00 -1.26 -4.27 105.19 109.61 1ce8 n GLY 117 Ca 0.02 -0.28 -0.12 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.66 0.63 4.61 0.00 -1.26 -4.00 121.76 121.08 1ce8 s ALA 118 Ca 0.00 0.93 -0.11 0.00 0.00 0.00 0.00 51.96 52.78 1ce8 s ALA 118 Cb 0.00 -0.57 -0.03 0.00 0.00 0.00 0.00 23.12 22.52 1ce8 s ALA 118 CO 0.00 -0.17 1.04 0.95 0.00 0.00 0.00 175.76 177.58 1ce8 s THR 119 N 0.71 4.52 0.23 0.00 -4.23 -1.26 -4.85 115.64 110.76 1ce8 s THR 119 Ca -0.05 0.82 -0.07 0.00 -1.18 0.00 0.00 61.69 61.21 1ce8 s THR 119 Cb -0.06 -3.81 0.19 0.00 1.34 0.00 0.00 72.50 70.16 1ce8 s THR 119 CO -0.04 -1.07 1.84 0.00 -0.54 0.00 0.00 174.62 174.81 1ce8 h ALA 120 N -0.37 1.08 -0.11 3.99 0.00 -1.98 0.12 119.26 121.99 1ce8 h ALA 120 Ca -0.44 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.36 1ce8 h ALA 120 Cb 1.20 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1ce8 h ALA 120 CO 0.62 0.23 -0.38 0.22 0.00 0.00 0.00 179.25 179.94 1ce8 h ASP 121 N 0.90 0.24 -0.21 0.00 3.58 -1.96 -0.44 116.42 118.53 1ce8 h ASP 121 Ca 0.34 -0.09 -0.13 0.00 0.42 0.00 0.00 57.03 57.57 1ce8 h ASP 121 Cb 0.14 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.12 1ce8 h ASP 121 CO -0.16 0.60 -0.39 0.00 -2.88 0.00 0.00 179.24 176.42 1ce8 h ALA 122 N 1.41 0.33 -0.58 -0.78 0.00 -1.41 0.50 119.26 118.72 1ce8 h ALA 122 Ca 0.02 -0.45 0.04 0.00 0.00 0.00 0.00 54.91 54.53 1ce8 h ALA 122 Cb 0.77 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 1ce8 h ALA 122 CO 0.06 0.42 0.33 0.82 0.00 0.00 0.00 179.25 180.88 1ce8 h ILE 123 N 0.33 1.00 -0.12 0.00 2.04 -0.55 -1.45 117.51 118.77 1ce8 h ILE 123 Ca 0.01 -0.22 -0.12 0.00 1.00 0.00 0.00 64.86 65.53 1ce8 h ILE 123 Cb 0.98 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 1ce8 h ILE 123 CO 0.09 0.12 -0.47 -0.78 0.00 0.00 0.00 178.15 177.10 1ce8 h ASP 124 N 0.63 0.31 0.12 1.72 1.82 -0.92 -0.47 116.42 119.63 1ce8 h ASP 124 Ca 0.25 -0.15 -0.02 0.00 -0.39 0.00 0.00 57.03 56.72 1ce8 h ASP 124 Cb 0.10 -0.09 -0.00 0.00 0.68 0.00 0.00 39.33 40.02 1ce8 h ASP 124 CO -0.14 0.74 -0.11 0.50 -1.61 0.00 0.00 179.24 178.62 1ce8 h LYS 125 N 0.23 0.00 0.06 0.28 3.64 0.11 -0.69 116.57 120.20 1ce8 h LYS 125 Ca 0.01 0.00 -0.35 0.00 -1.27 0.00 0.00 60.65 59.04 1ce8 h LYS 125 Cb 0.92 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.70 1ce8 h LYS 125 CO 0.08 0.11 -2.05 0.00 -2.27 0.00 0.00 179.45 175.32 1ce8 n ALA 126 N -2.50 1.19 0.10 5.00 0.00 -0.98 -1.96 120.51 121.36 1ce8 n ALA 126 Ca -0.03 -0.79 -0.03 0.00 0.00 0.00 0.00 53.44 52.59 1ce8 n ALA 126 Cb 0.18 -0.57 -0.02 0.00 0.00 0.00 0.00 19.45 19.04 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 0.04 0.00 -6.14 0.00 4.39 -1.03 -3.41 114.58 108.42 1ce8 h GLU 127 Ca -0.43 0.00 -0.59 0.00 0.34 0.00 0.00 59.36 58.68 1ce8 h GLU 127 Cb 2.03 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 30.57 1ce8 h GLU 127 CO 0.05 0.77 0.70 0.34 -1.16 0.00 0.00 179.01 179.71 1ce8 s ASP 128 N -6.62 6.40 0.57 1.42 -1.08 -0.27 -1.96 116.67 115.13 1ce8 s ASP 128 Ca 0.02 -0.13 0.27 0.00 -0.52 0.00 0.00 52.55 52.19 1ce8 s ASP 128 Cb 0.09 -2.48 1.59 0.00 -1.46 0.00 0.00 42.92 40.67 1ce8 s ASP 128 CO 0.78 -1.28 2.12 0.03 0.52 0.00 0.00 175.17 177.34 1ce8 h ARG 129 N 9.35 0.00 0.16 4.34 2.47 -1.88 -0.88 114.38 127.94 1ce8 h ARG 129 Ca -0.25 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.46 1ce8 h ARG 129 Cb 1.07 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.39 1ce8 h ARG 129 CO 1.11 0.00 -0.08 -0.09 0.56 0.00 0.00 179.97 181.47 1ce8 h ARG 130 N 0.00 -0.21 -0.38 0.04 2.43 -1.92 -2.04 114.38 112.30 1ce8 h ARG 130 Ca 0.08 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.32 1ce8 h ARG 130 Cb 0.41 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.97 1ce8 h ARG 130 CO -0.00 0.16 0.09 0.00 -1.51 0.00 0.00 179.97 178.72 1ce8 h ARG 131 N -0.64 0.22 -0.66 0.20 3.08 -1.59 -1.79 114.38 113.20 1ce8 h ARG 131 Ca -0.02 -0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.10 1ce8 h ARG 131 Cb 0.47 -0.05 -0.07 0.00 0.08 0.00 0.00 29.97 30.40 1ce8 h ARG 131 CO 0.04 0.15 0.30 0.35 -1.07 0.00 0.00 179.97 179.74 1ce8 h PHE 132 N 0.23 0.54 -0.73 3.04 3.57 -0.53 -0.61 116.94 122.45 1ce8 h PHE 132 Ca 0.18 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.72 1ce8 h PHE 132 Cb 0.19 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.75 1ce8 h PHE 132 CO -0.18 0.18 0.48 0.22 -2.23 0.00 0.00 178.31 176.78 1ce8 h ASP 133 N 0.53 0.81 -0.21 0.41 3.58 -0.57 -1.57 116.42 119.40 1ce8 h ASP 133 Ca 0.33 -0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.76 1ce8 h ASP 133 Cb 0.35 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.20 1ce8 h ASP 133 CO -0.27 0.58 0.13 0.58 -2.88 0.00 0.00 179.24 177.38 1ce8 h VAL 134 N 0.96 1.09 -0.88 2.25 2.07 -1.03 -1.96 116.25 118.75 1ce8 h VAL 134 Ca 0.27 -0.23 0.11 0.00 0.82 0.00 0.00 66.70 67.68 1ce8 h VAL 134 Cb -0.08 0.85 -0.07 0.00 -1.52 0.00 0.00 31.29 30.48 1ce8 h VAL 134 CO -0.07 0.09 0.57 0.00 0.02 0.00 0.00 177.57 178.18 1ce8 h ALA 135 N 1.03 1.70 -0.20 1.67 0.00 -0.71 0.88 119.26 123.63 1ce8 h ALA 135 Ca 0.08 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 1ce8 h ALA 135 Cb 0.03 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1ce8 h ALA 135 CO -0.01 0.10 -0.45 0.52 0.00 0.00 0.00 179.25 179.41 1ce8 h MET 136 N 0.82 0.51 -0.44 0.00 2.07 -0.91 -0.79 114.93 116.18 1ce8 h MET 136 Ca 0.42 -0.28 -0.13 0.00 -2.07 0.00 0.00 59.70 57.64 1ce8 h MET 136 Cb 0.50 0.01 -0.01 0.00 -1.87 0.00 0.00 31.60 30.23 1ce8 h MET 136 CO -0.18 0.86 -0.24 -0.22 1.07 0.00 0.00 176.91 178.19 1ce8 h LYS 137 N 0.41 0.95 -0.09 1.72 3.64 0.03 -0.43 116.57 122.80 1ce8 h LYS 137 Ca 0.03 -0.43 0.02 0.00 -1.27 0.00 0.00 60.65 59.00 1ce8 h LYS 137 Cb 0.95 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.73 1ce8 h LYS 137 CO 0.08 1.09 -0.03 -0.22 -2.27 0.00 0.00 179.45 178.11 1ce8 h LYS 138 N 0.79 -0.01 -0.07 1.90 3.64 0.12 -2.59 116.57 120.34 1ce8 h LYS 138 Ca 0.10 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1ce8 h LYS 138 Cb 0.82 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.65 1ce8 h LYS 138 CO 0.07 -0.01 0.00 0.44 -2.27 0.00 0.00 179.45 177.68 1ce8 n ILE 139 N -5.15 0.09 -1.01 2.00 -5.35 -0.35 -4.91 119.36 104.68 1ce8 n ILE 139 Ca -0.05 -0.11 -0.00 0.00 -0.27 0.00 0.00 62.75 62.32 1ce8 n ILE 139 Cb 0.08 -0.02 -0.00 0.00 -1.74 0.00 0.00 39.64 37.96 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 0.74 0.47 3.86 3.28 0.00 -0.68 -5.02 105.19 107.85 1ce8 n GLY 140 Ca 0.08 -0.36 -0.36 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.10 4.41 0.25 0.99 1.43 -0.26 -5.02 118.68 120.37 1ce8 s LEU 141 Ca 0.00 0.74 -0.25 0.00 -1.03 0.00 0.00 54.13 53.59 1ce8 s LEU 141 Cb 0.00 -2.58 -0.09 0.00 0.03 0.00 0.00 46.19 43.55 1ce8 s LEU 141 CO 0.00 0.30 0.85 -0.70 0.23 0.00 0.00 176.35 177.03 1ce8 s GLU 142 N -1.39 4.55 0.09 1.70 2.12 -1.26 -4.25 118.70 120.26 1ce8 s GLU 142 Ca 0.25 1.21 0.04 0.00 0.36 0.00 0.00 54.97 56.82 1ce8 s GLU 142 Cb -0.14 -3.02 -0.03 0.00 0.26 0.00 0.00 34.13 31.19 1ce8 s GLU 142 CO 0.13 0.42 -0.11 0.95 -0.54 0.00 0.00 175.26 176.12 1ce8 s THR 143 N -1.40 0.93 0.90 -1.70 -4.23 -1.26 -0.57 115.64 108.32 1ce8 s THR 143 Ca 0.43 -1.52 -0.11 0.00 -1.18 0.00 0.00 61.69 59.31 1ce8 s THR 143 Cb -0.21 -1.23 0.11 0.00 1.34 0.00 0.00 72.50 72.52 1ce8 s THR 143 CO 0.25 -0.48 1.01 0.00 -0.54 0.00 0.00 174.62 174.86 1ce8 n ALA 144 N 0.79 -1.04 -2.17 3.99 0.00 -1.26 -4.88 120.51 115.93 1ce8 n ALA 144 Ca -0.18 -0.53 -0.42 0.00 0.00 0.00 0.00 53.44 52.32 1ce8 n ALA 144 Cb 0.57 -2.13 -0.03 0.00 0.00 0.00 0.00 19.45 17.86 1ce8 n ALA 144 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1ce8 s ARG 145 N -4.33 4.28 0.32 0.00 3.52 -1.26 -4.86 118.95 116.62 1ce8 s ARG 145 Ca 0.66 2.03 0.02 0.00 -0.13 0.00 0.00 55.73 58.31 1ce8 s ARG 145 Cb -0.24 -3.52 -0.02 0.00 -1.56 0.00 0.00 34.95 29.61 1ce8 s ARG 145 CO 0.59 -0.57 0.35 -1.54 -0.81 0.00 0.00 175.30 173.31 1ce8 s SER 146 N 1.83 1.17 -0.20 -2.12 1.04 -1.26 -0.09 113.70 114.08 1ce8 s SER 146 Ca 0.65 -1.59 -0.15 0.00 0.48 0.00 0.00 55.95 55.34 1ce8 s SER 146 Cb -0.33 0.58 0.06 0.00 0.10 0.00 0.00 66.02 66.43 1ce8 s SER 146 CO 0.28 -1.14 0.51 -0.83 0.98 0.00 0.00 173.24 173.04 1ce8 s GLY 147 N -3.29 -0.41 0.27 7.32 0.00 -0.47 -4.97 107.32 105.77 1ce8 s GLY 147 Ca 0.36 1.63 -0.27 0.00 0.00 0.00 0.00 44.72 46.45 1ce8 s GLY 147 CO 0.23 1.57 0.90 -0.42 0.00 0.00 0.00 173.10 175.38 1ce8 s ILE 148 N 0.85 4.22 -0.03 0.90 -1.09 -1.26 -1.23 121.20 123.55 1ce8 s ILE 148 Ca -0.05 1.84 0.01 0.00 -2.23 0.00 0.00 60.65 60.23 1ce8 s ILE 148 Cb -0.05 -4.11 0.01 0.00 -1.58 0.00 0.00 42.46 36.73 1ce8 s ILE 148 CO -0.07 0.30 -0.05 0.00 -1.23 0.00 0.00 174.94 173.89 1ce8 s ALA 149 N -1.42 0.60 -0.05 9.38 0.00 0.13 -4.77 121.76 125.63 1ce8 s ALA 149 Ca 0.45 -0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.29 1ce8 s ALA 149 Cb -0.21 -0.30 -0.01 0.00 0.00 0.00 0.00 23.12 22.60 1ce8 s ALA 149 CO 0.26 0.05 0.05 0.72 0.00 0.00 0.00 175.76 176.84 1ce8 n HIS 150 N 3.60 0.00 -3.77 0.00 8.25 -1.26 0.44 115.22 122.48 1ce8 n HIS 150 Ca -0.21 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.16 1ce8 n HIS 150 Cb 0.53 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.58 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 -1.10 0.11 0.41 1.59 -4.23 -1.26 -4.90 115.64 106.26 1ce8 s THR 151 Ca 0.00 -0.93 0.09 0.00 -1.18 0.00 0.00 61.69 59.67 1ce8 s THR 151 Cb 0.01 -1.29 0.29 0.00 1.34 0.00 0.00 72.50 72.85 1ce8 s THR 151 CO 0.04 -0.50 2.02 -0.03 -0.54 0.00 0.00 174.62 175.62 1ce8 h MET 152 N 2.58 0.54 0.15 3.99 4.05 -1.96 0.41 114.93 124.68 1ce8 h MET 152 Ca -0.34 -0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.04 1ce8 h MET 152 Cb 1.22 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 31.90 1ce8 h MET 152 CO 0.52 0.36 -0.07 1.49 0.23 0.00 0.00 176.91 179.43 1ce8 h GLU 153 N 0.55 -0.19 -0.56 0.39 4.81 -1.99 0.48 114.58 118.07 1ce8 h GLU 153 Ca 0.22 0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.53 1ce8 h GLU 153 Cb 0.17 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.54 1ce8 h GLU 153 CO -0.06 0.13 0.24 0.93 -0.73 0.00 0.00 179.01 179.52 1ce8 h GLU 154 N -0.53 0.43 -0.32 1.92 5.08 -1.75 -1.46 114.58 117.94 1ce8 h GLU 154 Ca -0.02 -0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.38 1ce8 h GLU 154 Cb 0.41 -0.10 -0.07 0.00 0.50 0.00 0.00 28.75 29.50 1ce8 h GLU 154 CO 0.03 0.28 -0.15 0.00 -1.00 0.00 0.00 179.01 178.18 1ce8 h ALA 155 N 1.36 0.11 -0.60 3.43 0.00 0.09 -2.16 119.26 121.49 1ce8 h ALA 155 Ca 0.27 0.12 0.08 0.00 0.00 0.00 0.00 54.91 55.38 1ce8 h ALA 155 Cb 0.28 0.36 -0.07 0.00 0.00 0.00 0.00 17.79 18.36 1ce8 h ALA 155 CO -0.25 -0.53 0.25 -0.07 0.00 0.00 0.00 179.25 178.65 1ce8 h LEU 156 N -0.10 0.28 -1.55 0.00 3.38 0.97 -1.87 115.31 116.43 1ce8 h LEU 156 Ca 0.16 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 1ce8 h LEU 156 Cb 0.35 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 1ce8 h LEU 156 CO -0.38 0.17 0.14 0.00 0.09 0.00 0.00 178.44 178.46 1ce8 h ALA 157 N 1.39 1.65 -0.29 1.53 0.00 -0.74 -2.51 119.26 120.29 1ce8 h ALA 157 Ca 0.30 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 1ce8 h ALA 157 Cb 0.33 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1ce8 h ALA 157 CO -0.27 0.28 0.07 0.28 0.00 0.00 0.00 179.25 179.61 1ce8 h VAL 158 N 0.44 1.22 -0.86 0.00 2.07 -0.93 -2.28 116.25 115.91 1ce8 h VAL 158 Ca 0.11 -0.72 0.08 0.00 0.82 0.00 0.00 66.70 66.99 1ce8 h VAL 158 Cb 0.07 1.14 -0.06 0.00 -1.52 0.00 0.00 31.29 30.92 1ce8 h VAL 158 CO -0.01 0.24 0.56 0.00 0.02 0.00 0.00 177.57 178.37 1ce8 h ALA 159 N 0.90 1.62 -0.01 1.67 0.00 -1.24 0.34 119.26 122.54 1ce8 h ALA 159 Ca 0.09 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 1ce8 h ALA 159 Cb 0.29 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1ce8 h ALA 159 CO 0.00 0.22 -0.53 0.00 0.00 0.00 0.00 179.25 178.94 1ce8 h ALA 160 N 1.55 1.09 -0.04 0.00 0.00 -1.21 1.20 119.26 121.86 1ce8 h ALA 160 Ca 0.38 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1ce8 h ALA 160 Cb 0.32 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1ce8 h ALA 160 CO -0.15 0.67 -0.19 0.22 0.00 0.00 0.00 179.25 179.80 1ce8 h ASP 161 N 0.03 0.24 0.65 0.00 3.58 -0.10 -3.34 116.42 117.47 1ce8 h ASP 161 Ca -0.00 -0.65 -0.07 0.00 0.42 0.00 0.00 57.03 56.72 1ce8 h ASP 161 Cb 0.95 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.92 1ce8 h ASP 161 CO 0.07 0.85 -1.41 1.33 -2.88 0.00 0.00 179.24 177.20 1ce8 n VAL 162 N -4.57 0.72 -1.00 2.25 0.24 0.88 -5.09 118.33 111.77 1ce8 n VAL 162 Ca -0.09 -0.60 0.13 0.00 -2.04 0.00 0.00 64.34 61.75 1ce8 n VAL 162 Cb 0.43 -0.40 -0.04 0.00 -1.47 0.00 0.00 33.84 32.36 1ce8 n VAL 162 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ce8 n GLY 163 N 1.29 -1.96 3.88 7.63 0.00 0.41 -4.79 105.19 111.66 1ce8 n GLY 163 Ca -0.06 -1.26 -0.35 0.00 0.00 0.00 0.00 46.02 44.36 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 -2.20 3.59 0.64 1.61 0.08 -1.26 -3.79 117.98 116.63 1ce8 s PHE 164 Ca 0.00 0.63 -0.11 0.00 0.12 0.00 0.00 56.93 57.57 1ce8 s PHE 164 Cb 0.00 -2.03 -0.02 0.00 -0.57 0.00 0.00 43.02 40.40 1ce8 s PHE 164 CO 0.00 0.60 1.03 -1.25 -0.10 0.00 0.00 175.22 175.50 1ce8 s PRO 165 N -1.73 3.35 0.09 0.24 0.04 -1.26 -5.05 135.00 130.68 1ce8 s PRO 165 Ca 0.28 0.60 0.02 0.00 0.04 0.00 0.00 61.00 61.94 1ce8 s PRO 165 Cb -0.13 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.28 1ce8 s PRO 165 CO 0.16 -0.69 -0.07 0.00 0.04 0.00 0.00 177.00 176.44 1ce8 s ILE 167 N -3.24 4.47 -0.17 0.00 1.09 0.33 -1.43 121.20 122.25 1ce8 s ILE 167 Ca 0.08 -0.50 0.01 0.00 -1.10 0.00 0.00 60.65 59.14 1ce8 s ILE 167 Cb 0.03 -3.02 0.02 0.00 -1.06 0.00 0.00 42.46 38.42 1ce8 s ILE 167 CO -0.04 0.36 -0.20 -0.63 -0.10 0.00 0.00 174.94 174.33 1ce8 s ILE 168 N -1.15 2.02 -0.17 2.92 1.01 -0.45 -0.86 121.20 124.53 1ce8 s ILE 168 Ca 0.21 -0.92 -0.01 0.00 0.00 0.00 0.00 60.65 59.94 1ce8 s ILE 168 Cb -0.12 -1.82 0.04 0.00 0.01 0.00 0.00 42.46 40.57 1ce8 s ILE 168 CO 0.12 0.53 -0.05 -0.13 0.00 0.00 0.00 174.94 175.42 1ce8 s ARG 169 N 1.27 1.38 0.58 2.79 0.52 0.28 -2.81 118.95 122.97 1ce8 s ARG 169 Ca 0.04 -0.51 -0.18 0.00 -0.52 0.00 0.00 55.73 54.57 1ce8 s ARG 169 Cb -0.13 -2.00 -0.04 0.00 0.52 0.00 0.00 34.95 33.30 1ce8 s ARG 169 CO -0.12 -0.44 1.11 -2.14 0.02 0.00 0.00 175.30 173.73 1ce8 s PRO 170 N 1.65 3.21 0.40 3.54 0.02 -1.26 0.84 135.00 143.40 1ce8 s PRO 170 Ca 0.01 1.49 -0.12 0.00 0.02 0.00 0.00 61.00 62.39 1ce8 s PRO 170 Cb -0.15 -2.00 -0.07 0.00 0.02 0.00 0.00 34.50 32.30 1ce8 s PRO 170 CO -0.08 -0.94 0.79 -1.12 -0.33 0.00 0.00 177.00 175.32 1ce8 s SER 171 N -2.14 6.58 -1.11 2.53 0.01 -0.06 -3.94 113.70 115.57 1ce8 s SER 171 Ca 0.70 1.21 0.00 0.00 1.31 0.00 0.00 55.95 59.17 1ce8 s SER 171 Cb -0.22 -2.35 0.00 0.00 0.21 0.00 0.00 66.02 63.66 1ce8 s SER 171 CO 0.32 -0.39 0.00 0.49 0.41 0.00 0.00 173.24 174.07 1ce8 n PHE 172 N -1.16 -0.23 -4.23 2.43 3.01 -0.83 -3.81 117.46 112.65 1ce8 n PHE 172 Ca 0.03 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.36 1ce8 n PHE 172 Cb 0.54 -2.34 -0.10 0.00 -0.01 0.00 0.00 39.48 37.57 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 -2.48 0.96 0.27 4.37 -4.23 -1.25 -4.35 115.64 108.92 1ce8 s THR 173 Ca 0.00 -2.01 -0.03 0.00 -1.18 0.00 0.00 61.69 58.47 1ce8 s THR 173 Cb 0.00 -1.87 -0.02 0.00 1.34 0.00 0.00 72.50 71.95 1ce8 s THR 173 CO 0.00 -0.72 0.34 0.00 -0.54 0.00 0.00 174.62 173.70 1ce8 s MET 174 N -3.80 1.58 -1.55 3.99 0.23 -1.26 -4.84 119.30 113.64 1ce8 s MET 174 Ca 0.17 -1.64 0.00 0.00 -1.03 0.00 0.00 55.69 53.19 1ce8 s MET 174 Cb 0.04 0.38 0.00 0.00 -1.53 0.00 0.00 34.83 33.72 1ce8 s MET 174 CO 0.00 -0.61 0.00 0.41 -2.03 0.00 0.00 175.02 172.79 1ce8 n GLY 175 N -0.44 1.17 2.57 3.16 0.00 -1.26 -1.54 105.19 108.84 1ce8 n GLY 175 Ca 0.02 -0.29 -0.04 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.08 0.53 3.68 -0.02 0.00 -1.25 -1.31 105.19 105.73 1ce8 n GLY 176 Ca -0.16 -0.11 -0.48 0.00 0.00 0.00 0.00 46.02 45.27 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 -0.51 3.51 0.00 1.61 7.64 -0.59 -1.15 113.62 124.13 1ce8 n SER 177 Ca -0.04 0.97 0.00 0.00 1.01 0.00 0.00 58.87 60.81 1ce8 n SER 177 Cb 0.35 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.17 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 4.39 0.83 0.38 0.23 0.00 -1.26 -4.64 105.19 105.12 1ce8 n GLY 178 Ca 0.22 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.22 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 -2.23 3.04 0.00 -0.02 0.00 -0.30 -2.95 105.19 102.73 1ce8 n GLY 179 Ca 0.00 -2.18 0.00 0.00 0.00 0.00 0.00 46.02 43.84 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 4.34 -2.43 3.41 -0.02 0.00 -1.12 -4.48 105.19 104.88 1ce8 n GLY 180 Ca -0.00 -1.24 -0.36 0.00 0.00 0.00 0.00 46.02 44.41 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 -2.07 4.09 -0.45 -0.61 1.01 -1.26 -1.34 121.20 120.57 1ce8 s ILE 181 Ca 0.00 -0.27 -0.20 0.00 0.00 0.00 0.00 60.65 60.17 1ce8 s ILE 181 Cb 0.00 -2.92 0.03 0.00 0.01 0.00 0.00 42.46 39.58 1ce8 s ILE 181 CO 0.00 0.34 0.63 0.00 0.00 0.00 0.00 174.94 175.91 1ce8 s ALA 182 N 1.58 3.35 -0.78 9.38 0.00 -0.51 -4.90 121.76 129.88 1ce8 s ALA 182 Ca 0.06 -1.34 0.25 0.00 0.00 0.00 0.00 51.96 50.93 1ce8 s ALA 182 Cb -0.15 -3.30 0.54 0.00 0.00 0.00 0.00 23.12 20.20 1ce8 s ALA 182 CO 0.02 -1.83 1.46 0.66 0.00 0.00 0.00 175.76 176.07 1ce8 n TYR 183 N 6.23 0.39 -3.69 0.00 4.01 -1.26 -2.29 117.16 120.55 1ce8 n TYR 183 Ca -0.03 0.11 -0.09 0.00 -0.16 0.00 0.00 57.90 57.73 1ce8 n TYR 183 Cb 0.47 -0.57 -0.03 0.00 -0.31 0.00 0.00 39.34 38.91 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 -3.81 -0.35 0.36 7.72 2.20 -1.26 -4.79 114.94 115.01 1ce8 s ASN 184 Ca 0.09 -0.39 0.10 0.00 -0.94 0.00 0.00 52.86 51.72 1ce8 s ASN 184 Cb 0.15 0.64 0.86 0.00 -2.00 0.00 0.00 41.25 40.90 1ce8 s ASN 184 CO 0.68 -1.14 1.84 -0.09 -2.94 0.00 0.00 177.10 175.45 1ce8 h ARG 185 N 2.06 0.63 0.54 3.55 2.43 -1.98 0.15 114.38 121.76 1ce8 h ARG 185 Ca -0.27 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 58.84 1ce8 h ARG 185 Cb 1.27 -0.14 0.01 0.00 -0.42 0.00 0.00 29.97 30.69 1ce8 h ARG 185 CO 0.32 0.41 -0.26 1.49 -1.51 0.00 0.00 179.97 180.42 1ce8 h GLU 186 N 0.65 -0.70 -0.53 0.20 4.81 -2.00 -1.18 114.58 115.83 1ce8 h GLU 186 Ca 0.49 0.05 0.05 0.00 -0.13 0.00 0.00 59.36 59.81 1ce8 h GLU 186 Cb 0.89 0.16 -0.05 0.00 0.63 0.00 0.00 28.75 30.38 1ce8 h GLU 186 CO -0.24 -0.45 0.27 0.93 -0.73 0.00 0.00 179.01 178.79 1ce8 h GLU 187 N -0.78 0.51 -0.39 1.92 5.08 -1.82 -2.43 114.58 116.68 1ce8 h GLU 187 Ca -0.07 -0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.32 1ce8 h GLU 187 Cb 0.58 -0.12 -0.09 0.00 0.50 0.00 0.00 28.75 29.62 1ce8 h GLU 187 CO 0.12 0.34 -0.42 0.35 -1.00 0.00 0.00 179.01 178.40 1ce8 h PHE 188 N 0.53 -1.23 -0.92 4.33 3.57 -0.49 0.16 116.94 122.88 1ce8 h PHE 188 Ca 0.23 0.07 0.04 0.00 3.53 0.00 0.00 57.97 61.84 1ce8 h PHE 188 Cb 0.14 0.60 -0.05 0.00 2.79 0.00 0.00 35.95 39.42 1ce8 h PHE 188 CO -0.10 -0.44 0.60 0.93 -2.23 0.00 0.00 178.31 177.07 1ce8 h GLU 189 N -0.33 1.11 0.11 1.11 5.08 -0.94 -0.26 114.58 120.47 1ce8 h GLU 189 Ca 0.14 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1ce8 h GLU 189 Cb 0.58 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1ce8 h GLU 189 CO -0.56 0.73 -0.05 1.49 -1.00 0.00 0.00 179.01 179.61 1ce8 h GLU 190 N 1.14 -0.15 0.17 2.33 4.81 -0.77 -2.16 114.58 119.95 1ce8 h GLU 190 Ca 0.37 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.60 1ce8 h GLU 190 Cb 0.04 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.45 1ce8 h GLU 190 CO -0.12 0.11 -0.09 0.82 -0.73 0.00 0.00 179.01 179.01 1ce8 h ILE 191 N -0.40 0.82 -0.79 2.32 2.04 -0.43 -2.22 117.51 118.85 1ce8 h ILE 191 Ca -0.02 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.92 1ce8 h ILE 191 Cb 0.33 0.82 -0.07 0.00 -0.74 0.00 0.00 36.82 37.16 1ce8 h ILE 191 CO 0.03 0.00 0.46 0.00 0.00 0.00 0.00 178.15 178.63 1ce8 h ALA 193 N 1.41 0.46 0.16 0.00 0.00 -1.30 0.62 119.26 120.61 1ce8 h ALA 193 Ca 0.36 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1ce8 h ALA 193 Cb 0.27 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1ce8 h ALA 193 CO -0.21 -0.08 -0.14 -0.09 0.00 0.00 0.00 179.25 178.73 1ce8 h ARG 194 N 0.49 -0.30 -0.50 0.00 2.43 -0.62 -2.70 114.38 113.18 1ce8 h ARG 194 Ca 0.13 0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.25 1ce8 h ARG 194 Cb -0.06 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 1ce8 h ARG 194 CO -0.03 -0.20 0.01 0.78 -1.51 0.00 0.00 179.97 179.02 1ce8 h GLY 195 N -0.32 0.94 0.94 2.80 0.00 -0.58 -2.53 103.07 104.33 1ce8 h GLY 195 Ca -0.00 -0.69 0.02 0.00 0.00 0.00 0.00 47.33 46.66 1ce8 h GLY 195 CO -0.02 0.63 0.65 1.41 0.00 0.00 0.00 176.54 179.21 1ce8 h LEU 196 N 0.74 1.10 -0.44 3.11 3.38 -0.86 0.21 115.31 122.56 1ce8 h LEU 196 Ca 0.14 -0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.92 1ce8 h LEU 196 Cb 0.50 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1ce8 h LEU 196 CO 0.02 0.78 -0.77 -0.78 0.09 0.00 0.00 178.44 177.78 1ce8 h ASP 197 N 1.29 0.16 0.76 -0.43 3.58 -1.46 -3.29 116.42 117.03 1ce8 h ASP 197 Ca 0.38 -0.12 -0.25 0.00 0.42 0.00 0.00 57.03 57.46 1ce8 h ASP 197 Cb -0.08 -0.05 -0.04 0.00 1.72 0.00 0.00 39.33 40.89 1ce8 h ASP 197 CO -0.10 0.87 -1.33 0.25 -2.88 0.00 0.00 179.24 176.04 1ce8 h LEU 198 N 0.08 0.01 -9.49 2.28 5.85 -1.11 -3.46 115.31 109.47 1ce8 h LEU 198 Ca -0.02 -0.02 -0.53 0.00 0.84 0.00 0.00 57.88 58.15 1ce8 h LEU 198 Cb 1.36 -0.00 0.04 0.00 0.37 0.00 0.00 40.66 42.42 1ce8 h LEU 198 CO 0.11 1.01 1.13 -0.24 -0.34 0.00 0.00 178.44 180.12 1ce8 n SER 199 N -3.22 4.08 -0.17 1.25 2.88 0.72 -4.88 113.62 114.29 1ce8 n SER 199 Ca -0.08 0.97 0.06 0.00 -1.33 0.00 0.00 58.87 58.50 1ce8 n SER 199 Cb 0.99 -1.55 0.36 0.00 -0.75 0.00 0.00 64.21 63.26 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 8.85 0.73 -0.13 -1.46 0.11 -1.76 0.65 132.00 139.00 1ce8 h PRO 200 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1ce8 h PRO 200 Cb 1.22 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1ce8 h PRO 200 CO 0.95 0.48 0.00 0.25 -0.21 0.00 0.00 178.00 179.47 1ce8 n THR 201 N -4.48 0.14 -3.75 -1.15 -2.24 -1.26 -4.97 114.28 96.58 1ce8 n THR 201 Ca 0.10 -0.47 -0.24 0.00 -2.27 0.00 0.00 64.05 61.16 1ce8 n THR 201 Cb 0.22 0.99 0.04 0.00 -2.10 0.00 0.00 70.33 69.48 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 0.96 -5.62 -4.11 -0.78 4.81 0.22 -4.99 118.16 108.65 1ce8 n LYS 202 Ca 0.17 0.65 -0.14 0.00 -0.87 0.00 0.00 58.31 58.12 1ce8 n LYS 202 Cb 0.51 -5.42 -0.11 0.00 0.02 0.00 0.00 35.03 30.02 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 -6.20 0.67 0.10 1.64 2.12 -1.26 -4.63 118.70 111.14 1ce8 s GLU 203 Ca 0.31 -0.93 0.04 0.00 0.36 0.00 0.00 54.97 54.75 1ce8 s GLU 203 Cb -0.15 -0.41 -0.04 0.00 0.26 0.00 0.00 34.13 33.79 1ce8 s GLU 203 CO 0.80 0.07 -0.11 -0.51 -0.54 0.00 0.00 175.26 174.98 1ce8 s LEU 204 N -1.93 2.41 -0.12 2.70 1.43 0.17 -0.88 118.68 122.46 1ce8 s LEU 204 Ca -0.03 -0.82 0.02 0.00 -1.03 0.00 0.00 54.13 52.27 1ce8 s LEU 204 Cb -0.07 -0.34 -0.01 0.00 0.03 0.00 0.00 46.19 45.81 1ce8 s LEU 204 CO 0.00 -0.25 -0.19 -0.22 0.23 0.00 0.00 176.35 175.92 1ce8 s LEU 205 N -2.47 2.37 -0.20 1.79 2.96 0.25 0.19 118.68 123.57 1ce8 s LEU 205 Ca 0.06 -0.46 0.00 0.00 -0.22 0.00 0.00 54.13 53.51 1ce8 s LEU 205 Cb -0.03 -1.50 0.02 0.00 0.50 0.00 0.00 46.19 45.18 1ce8 s LEU 205 CO 0.00 0.15 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.41 1ce8 s ILE 206 N 0.40 2.37 0.21 6.68 1.01 -0.37 0.10 121.20 131.60 1ce8 s ILE 206 Ca -0.14 -0.93 0.11 0.00 0.00 0.00 0.00 60.65 59.69 1ce8 s ILE 206 Cb -0.17 -2.07 -0.04 0.00 0.01 0.00 0.00 42.46 40.19 1ce8 s ILE 206 CO 0.07 0.44 -0.22 -1.81 0.00 0.00 0.00 174.94 173.42 1ce8 s ASP 207 N 1.31 3.56 0.91 3.58 1.11 -0.04 -1.37 116.67 125.72 1ce8 s ASP 207 Ca 0.03 -0.86 -0.11 0.00 0.18 0.00 0.00 52.55 51.80 1ce8 s ASP 207 Cb -0.14 -0.32 0.14 0.00 1.07 0.00 0.00 42.92 43.67 1ce8 s ASP 207 CO -0.10 0.11 1.10 -1.83 1.18 0.00 0.00 175.17 175.62 1ce8 s GLU 208 N -2.82 1.11 -0.05 8.23 -1.05 0.88 -0.51 118.70 124.49 1ce8 s GLU 208 Ca 0.23 1.08 -0.29 0.00 -0.15 0.00 0.00 54.97 55.84 1ce8 s GLU 208 Cb -0.08 -1.77 -0.02 0.00 -0.44 0.00 0.00 34.13 31.82 1ce8 s GLU 208 CO 0.11 -2.42 0.95 0.45 0.95 0.00 0.00 175.26 175.31 1ce8 s SER 209 N -3.10 7.27 -0.09 0.83 0.15 -1.24 -4.61 113.70 112.91 1ce8 s SER 209 Ca 0.64 1.55 0.13 0.00 0.70 0.00 0.00 55.95 58.98 1ce8 s SER 209 Cb -0.20 -2.54 0.20 0.00 -1.71 0.00 0.00 66.02 61.77 1ce8 s SER 209 CO 0.58 -0.31 1.10 0.18 1.20 0.00 0.00 173.24 175.98 1ce8 n LEU 210 N 4.30 2.09 -4.66 3.45 4.77 -1.26 -5.05 117.00 120.64 1ce8 n LEU 210 Ca 0.06 -2.66 -0.47 0.00 -0.03 0.00 0.00 56.01 52.91 1ce8 n LEU 210 Cb 0.50 -0.30 -0.04 0.00 -2.33 0.00 0.00 43.42 41.25 1ce8 n LEU 210 CO 0.51 0.62 1.15 -0.38 -1.33 0.00 0.00 177.39 177.97 1ce8 n ILE 211 N -1.12 0.01 0.00 -0.08 5.41 -1.26 -1.65 119.36 120.67 1ce8 n ILE 211 Ca 0.11 -0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.86 1ce8 n ILE 211 Cb 0.55 -1.43 0.00 0.00 -0.71 0.00 0.00 39.64 38.05 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 3.28 2.88 3.81 7.39 0.00 -1.05 -4.95 105.19 116.55 1ce8 n GLY 212 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.78 2.67 0.41 1.61 0.52 -0.66 -4.68 118.94 116.04 1ce8 s TRP 213 Ca 0.00 0.88 -0.23 0.00 0.02 0.00 0.00 56.10 56.77 1ce8 s TRP 213 Cb 0.00 -3.36 -0.09 0.00 -1.15 0.00 0.00 33.47 28.87 1ce8 s TRP 213 CO 0.00 -2.14 1.06 0.15 0.02 0.00 0.00 176.95 176.04 1ce8 s LYS 214 N -5.32 4.09 -0.10 4.98 1.02 0.03 -0.82 119.74 123.63 1ce8 s LYS 214 Ca 0.63 1.51 0.03 0.00 0.02 0.00 0.00 55.97 58.16 1ce8 s LYS 214 Cb -0.14 -2.47 0.00 0.00 -0.52 0.00 0.00 37.83 34.70 1ce8 s LYS 214 CO 0.53 -0.21 -0.21 -2.00 -0.92 0.00 0.00 175.35 172.54 1ce8 s GLU 215 N -2.61 2.74 0.11 1.68 2.12 -1.26 0.53 118.70 122.01 1ce8 s GLU 215 Ca 0.59 -0.77 0.04 0.00 0.36 0.00 0.00 54.97 55.20 1ce8 s GLU 215 Cb -0.22 -2.11 -0.04 0.00 0.26 0.00 0.00 34.13 32.02 1ce8 s GLU 215 CO 0.27 0.12 -0.11 0.71 -0.54 0.00 0.00 175.26 175.72 1ce8 s TYR 216 N 0.48 1.15 0.04 5.30 2.02 -0.91 -1.48 117.35 123.95 1ce8 s TYR 216 Ca -0.16 -0.68 -0.00 0.00 -0.37 0.00 0.00 57.07 55.86 1ce8 s TYR 216 Cb -0.17 -0.62 -0.03 0.00 -0.40 0.00 0.00 41.96 40.74 1ce8 s TYR 216 CO 0.06 0.04 -0.04 -1.21 -1.57 0.00 0.00 175.55 172.83 1ce8 s GLU 217 N -3.05 0.48 -0.02 -0.62 2.02 -0.83 -0.00 118.70 116.68 1ce8 s GLU 217 Ca 0.09 -0.90 -0.01 0.00 0.02 0.00 0.00 54.97 54.17 1ce8 s GLU 217 Cb -0.02 0.10 0.01 0.00 0.10 0.00 0.00 34.13 34.33 1ce8 s GLU 217 CO 0.00 -0.06 0.04 -1.64 0.02 0.00 0.00 175.26 173.62 1ce8 s MET 218 N -2.58 0.02 -0.25 1.61 -1.94 -0.58 -0.90 119.30 114.69 1ce8 s MET 218 Ca -0.05 0.11 -0.11 0.00 -1.71 0.00 0.00 55.69 53.93 1ce8 s MET 218 Cb -0.02 -0.07 -0.05 0.00 2.01 0.00 0.00 34.83 36.70 1ce8 s MET 218 CO -0.05 -0.06 0.18 -1.21 -0.01 0.00 0.00 175.02 173.87 1ce8 s GLU 219 N 0.40 4.05 0.17 2.03 0.41 -0.02 -1.45 118.70 124.29 1ce8 s GLU 219 Ca -0.03 -0.25 0.10 0.00 -0.41 0.00 0.00 54.97 54.38 1ce8 s GLU 219 Cb -0.05 -3.57 -0.04 0.00 -1.78 0.00 0.00 34.13 28.70 1ce8 s GLU 219 CO -0.01 0.00 -0.17 0.08 -0.49 0.00 0.00 175.26 174.66 1ce8 s VAL 220 N 1.23 2.76 -0.02 2.63 1.01 0.15 -1.41 120.40 126.75 1ce8 s VAL 220 Ca 0.08 -1.79 0.04 0.00 0.00 0.00 0.00 61.98 60.31 1ce8 s VAL 220 Cb -0.14 -2.33 -0.01 0.00 0.00 0.00 0.00 36.38 33.90 1ce8 s VAL 220 CO 0.06 -0.07 -0.13 -0.69 0.00 0.00 0.00 175.10 174.27 1ce8 s VAL 221 N -1.58 1.09 0.04 2.92 1.01 0.08 -0.54 120.40 123.43 1ce8 s VAL 221 Ca 0.22 -0.57 0.03 0.00 0.00 0.00 0.00 61.98 61.66 1ce8 s VAL 221 Cb -0.09 -0.93 -0.02 0.00 0.00 0.00 0.00 36.38 35.34 1ce8 s VAL 221 CO 0.12 0.32 -0.10 -0.60 0.00 0.00 0.00 175.10 174.84 1ce8 s ARG 222 N -0.15 0.63 0.31 2.72 3.52 0.40 0.15 118.95 126.53 1ce8 s ARG 222 Ca 0.02 -0.74 0.06 0.00 -0.13 0.00 0.00 55.73 54.94 1ce8 s ARG 222 Cb -0.07 -0.49 -0.06 0.00 -1.56 0.00 0.00 34.95 32.76 1ce8 s ARG 222 CO 0.00 0.11 -0.02 0.16 -0.81 0.00 0.00 175.30 174.74 1ce8 s ASP 223 N -1.41 2.87 0.54 -2.12 1.47 -0.66 -1.04 116.67 116.32 1ce8 s ASP 223 Ca -0.06 -1.26 0.28 0.00 1.18 0.00 0.00 52.55 52.69 1ce8 s ASP 223 Cb -0.09 -0.19 1.44 0.00 -0.34 0.00 0.00 42.92 43.74 1ce8 s ASP 223 CO 0.01 -0.42 1.95 0.07 0.68 0.00 0.00 175.17 177.46 1ce8 h LYS 224 N 2.15 0.00 0.00 2.11 2.10 -1.73 0.44 116.57 121.64 1ce8 h LYS 224 Ca -0.41 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.24 1ce8 h LYS 224 Cb 1.24 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.57 1ce8 h LYS 224 CO 0.70 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 178.24 1ce8 n ASN 225 N -4.27 0.00 -0.35 7.07 3.02 -1.26 -4.83 115.26 114.63 1ce8 n ASN 225 Ca 0.13 -1.51 -0.05 0.00 -0.03 0.00 0.00 54.58 53.12 1ce8 n ASN 225 Cb 0.74 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.89 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 -0.74 -4.41 -4.76 6.41 2.03 0.15 -4.96 116.55 110.27 1ce8 n ASP 226 Ca 0.11 0.11 -0.41 0.00 0.52 0.00 0.00 54.79 55.13 1ce8 n ASP 226 Cb 0.05 -2.32 -0.03 0.00 -0.72 0.00 0.00 41.12 38.10 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 -2.39 7.00 -0.05 1.67 0.01 -1.25 -4.81 114.94 115.13 1ce8 s ASN 227 Ca 0.00 2.46 0.00 0.00 -0.71 0.00 0.00 52.86 54.61 1ce8 s ASN 227 Cb 0.00 -2.63 0.02 0.00 0.41 0.00 0.00 41.25 39.05 1ce8 s ASN 227 CO 0.00 -0.37 -0.03 0.00 -1.51 0.00 0.00 177.10 175.20 1ce8 s ILE 229 N 1.13 1.70 -0.47 0.00 -4.36 0.12 -4.97 121.20 114.35 1ce8 s ILE 229 Ca -0.08 -1.75 -0.13 0.00 -0.26 0.00 0.00 60.65 58.43 1ce8 s ILE 229 Cb -0.14 -1.69 0.09 0.00 1.25 0.00 0.00 42.46 41.98 1ce8 s ILE 229 CO -0.01 -0.24 0.36 -0.63 0.24 0.00 0.00 174.94 174.66 1ce8 s ILE 230 N -1.74 4.79 0.19 8.37 -1.09 -1.26 -0.74 121.20 129.72 1ce8 s ILE 230 Ca 0.11 -1.33 0.02 0.00 -2.23 0.00 0.00 60.65 57.23 1ce8 s ILE 230 Cb -0.07 -3.95 -0.11 0.00 -1.58 0.00 0.00 42.46 36.75 1ce8 s ILE 230 CO 0.05 -0.63 1.45 0.58 -1.23 0.00 0.00 174.94 175.16 1ce8 h VAL 231 N 5.92 1.44 -1.55 2.92 2.07 -1.55 -3.37 116.25 122.12 1ce8 h VAL 231 Ca -0.26 -2.32 0.08 0.00 0.82 0.00 0.00 66.70 65.02 1ce8 h VAL 231 Cb 1.10 2.25 -0.24 0.00 -1.52 0.00 0.00 31.29 32.87 1ce8 h VAL 231 CO 0.87 0.68 0.53 0.00 0.02 0.00 0.00 177.57 179.67 1ce8 s SER 233 N -0.70 4.01 -0.02 0.00 1.04 -1.26 -0.84 113.70 115.94 1ce8 s SER 233 Ca 0.00 -0.40 0.02 0.00 0.48 0.00 0.00 55.95 56.05 1ce8 s SER 233 Cb -0.02 -0.70 0.00 0.00 0.10 0.00 0.00 66.02 65.40 1ce8 s SER 233 CO -0.01 0.24 -0.07 -0.63 0.98 0.00 0.00 173.24 173.75 1ce8 s ILE 234 N -1.01 0.58 -0.18 -1.02 1.01 -0.08 -3.72 121.20 116.79 1ce8 s ILE 234 Ca 0.16 -0.28 0.01 0.00 0.00 0.00 0.00 60.65 60.54 1ce8 s ILE 234 Cb -0.11 -0.52 0.02 0.00 0.01 0.00 0.00 42.46 41.86 1ce8 s ILE 234 CO 0.07 0.18 -0.18 -0.70 0.00 0.00 0.00 174.94 174.31 1ce8 s GLU 235 N 0.09 3.04 0.32 2.79 2.12 0.91 -1.96 118.70 126.00 1ce8 s GLU 235 Ca -0.01 -0.81 -0.29 0.00 0.36 0.00 0.00 54.97 54.23 1ce8 s GLU 235 Cb -0.06 -2.61 -0.10 0.00 0.26 0.00 0.00 34.13 31.62 1ce8 s GLU 235 CO -0.00 -0.18 1.24 -0.80 -0.54 0.00 0.00 175.26 174.97 1ce8 s ASN 236 N 1.25 6.93 -0.14 -1.70 0.02 -0.55 -1.06 114.94 119.69 1ce8 s ASN 236 Ca 0.04 2.55 -0.26 0.00 -1.02 0.00 0.00 52.86 54.17 1ce8 s ASN 236 Cb -0.13 -2.64 -0.25 0.00 0.02 0.00 0.00 41.25 38.24 1ce8 s ASN 236 CO -0.10 -0.41 0.63 0.15 0.02 0.00 0.00 177.10 177.39 1ce8 h PHE 237 N 3.51 0.09 -3.60 2.20 3.04 -0.59 -3.44 116.94 118.16 1ce8 h PHE 237 Ca -0.48 -0.06 -0.51 0.00 3.98 0.00 0.00 57.97 60.89 1ce8 h PHE 237 Cb 1.22 -0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.72 1ce8 h PHE 237 CO 0.57 1.19 0.40 -0.51 -2.02 0.00 0.00 178.31 177.94 1ce8 s ASP 238 N -6.51 7.45 1.23 0.41 1.01 -1.23 -4.49 116.67 114.54 1ce8 s ASP 238 Ca -0.21 1.92 -0.16 0.00 0.71 0.00 0.00 52.55 54.80 1ce8 s ASP 238 Cb 0.00 -2.60 0.25 0.00 1.01 0.00 0.00 42.92 41.58 1ce8 s ASP 238 CO 0.69 -0.08 0.80 0.00 0.21 0.00 0.00 175.17 176.79 1ce8 n ALA 239 N 2.43 -2.91 -1.71 5.23 0.00 -1.26 -4.77 120.51 117.52 1ce8 n ALA 239 Ca 0.02 -1.24 -0.42 0.00 0.00 0.00 0.00 53.44 51.80 1ce8 n ALA 239 Cb 0.48 -0.09 0.00 0.00 0.00 0.00 0.00 19.45 19.84 1ce8 n ALA 239 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1ce8 n MET 240 N -4.24 2.17 0.00 0.00 2.81 0.00 -2.81 117.12 115.04 1ce8 n MET 240 Ca 0.11 0.76 0.00 0.00 -1.81 0.00 0.00 57.70 56.77 1ce8 n MET 240 Cb 0.45 -2.41 0.00 0.00 -0.71 0.00 0.00 33.22 30.55 1ce8 n MET 240 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ce8 n GLY 241 N 0.72 1.10 3.20 3.03 0.00 -1.26 -2.52 105.19 109.45 1ce8 n GLY 241 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.39 2.51 0.31 -0.61 1.01 -1.12 -3.11 121.20 118.79 1ce8 s ILE 242 Ca 0.00 -0.79 -0.27 0.00 0.00 0.00 0.00 60.65 59.59 1ce8 s ILE 242 Cb 0.00 -2.08 -0.14 0.00 0.01 0.00 0.00 42.46 40.25 1ce8 s ILE 242 CO 0.00 0.50 0.84 1.57 0.00 0.00 0.00 174.94 177.85 1ce8 n HIS 243 N 4.56 0.63 -0.24 3.97 -0.00 -0.18 -4.72 115.22 119.25 1ce8 n HIS 243 Ca -0.20 0.73 0.12 0.00 -0.00 0.00 0.00 57.72 58.37 1ce8 n HIS 243 Cb 0.51 -2.15 0.40 0.00 -0.00 0.00 0.00 29.99 28.75 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 1.56 0.85 0.00 3.57 1.35 -1.93 -0.57 112.91 117.74 1ce8 h THR 244 Ca -0.38 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.26 1ce8 h THR 244 Cb 1.37 0.15 0.00 0.00 -1.73 0.00 0.00 68.15 67.94 1ce8 h THR 244 CO 0.58 0.12 0.00 1.23 -0.25 0.00 0.00 175.52 177.20 1ce8 h GLY 245 N 0.64 0.00 -1.70 5.82 0.00 -1.98 -2.44 103.07 103.42 1ce8 h GLY 245 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.75 1ce8 h GLY 245 CO -0.18 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.58 1ce8 n ASP 246 N -2.63 3.01 -4.87 0.19 9.92 -0.29 -4.71 116.55 117.17 1ce8 n ASP 246 Ca 0.01 -1.88 -0.23 0.00 -0.53 0.00 0.00 54.79 52.16 1ce8 n ASP 246 Cb 0.25 -0.21 -0.04 0.00 -0.64 0.00 0.00 41.12 40.48 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 -1.16 5.81 0.16 -2.24 0.01 -0.80 -4.85 113.70 110.63 1ce8 s SER 247 Ca 0.29 -0.11 -0.25 0.00 1.31 0.00 0.00 55.95 57.19 1ce8 s SER 247 Cb 0.17 -1.58 -0.08 0.00 0.21 0.00 0.00 66.02 64.74 1ce8 s SER 247 CO 0.23 -0.02 0.78 -0.63 0.41 0.00 0.00 173.24 174.00 1ce8 s ILE 248 N -1.99 4.37 0.02 1.44 1.01 -1.26 -4.29 121.20 120.50 1ce8 s ILE 248 Ca 0.33 1.71 -0.04 0.00 0.00 0.00 0.00 60.65 62.64 1ce8 s ILE 248 Cb -0.09 -4.14 -0.01 0.00 0.01 0.00 0.00 42.46 38.23 1ce8 s ILE 248 CO 0.26 0.52 0.07 0.42 0.00 0.00 0.00 174.94 176.21 1ce8 s THR 249 N -1.12 0.11 0.14 2.92 -4.23 -0.26 0.19 115.64 113.39 1ce8 s THR 249 Ca 0.36 -0.92 0.04 0.00 -1.18 0.00 0.00 61.69 59.99 1ce8 s THR 249 Cb -0.23 -0.56 -0.04 0.00 1.34 0.00 0.00 72.50 73.00 1ce8 s THR 249 CO 0.26 -0.51 -0.10 0.68 -0.54 0.00 0.00 174.62 174.42 1ce8 s VAL 250 N -1.88 1.12 0.00 2.29 -7.23 -0.23 0.12 120.40 114.61 1ce8 s VAL 250 Ca -0.11 -2.03 0.03 0.00 -1.81 0.00 0.00 61.98 58.05 1ce8 s VAL 250 Cb -0.06 -1.82 -0.01 0.00 0.56 0.00 0.00 36.38 35.06 1ce8 s VAL 250 CO -0.01 -0.75 -0.10 0.00 -0.31 0.00 0.00 175.10 173.93 1ce8 s ALA 251 N -3.31 0.80 1.00 1.32 0.00 -0.61 -0.06 121.76 120.90 1ce8 s ALA 251 Ca 0.16 -0.48 0.00 0.00 0.00 0.00 0.00 51.96 51.64 1ce8 s ALA 251 Cb 0.03 -0.18 0.00 0.00 0.00 0.00 0.00 23.12 22.97 1ce8 s ALA 251 CO 0.00 0.18 0.00 -0.35 0.00 0.00 0.00 175.76 175.59 1ce8 n PRO 252 N 2.62 0.56 -2.35 0.00 -0.04 -1.26 -1.29 135.00 133.24 1ce8 n PRO 252 Ca -0.15 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 62.97 1ce8 n PRO 252 Cb 0.56 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 34.01 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 -3.93 2.76 -0.09 0.55 0.00 -1.24 -4.36 121.76 115.45 1ce8 s ALA 253 Ca 0.00 0.70 0.04 0.00 0.00 0.00 0.00 51.96 52.69 1ce8 s ALA 253 Cb 0.00 -3.31 -0.08 0.00 0.00 0.00 0.00 23.12 19.74 1ce8 s ALA 253 CO 0.00 -0.60 -0.03 1.04 0.00 0.00 0.00 175.76 176.17 1ce8 n GLN 254 N -1.24 1.44 -0.66 0.00 1.13 -1.26 -4.79 117.38 111.99 1ce8 n GLN 254 Ca 0.10 0.03 0.01 0.00 -1.94 0.00 0.00 57.00 55.20 1ce8 n GLN 254 Cb 0.52 -1.19 0.24 0.00 0.11 0.00 0.00 30.24 29.91 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 -2.54 2.49 -3.92 5.09 -2.24 -1.26 -5.00 114.28 106.89 1ce8 n THR 255 Ca -0.15 -2.19 -0.34 0.00 -2.27 0.00 0.00 64.05 59.11 1ce8 n THR 255 Cb 0.71 -0.30 -0.05 0.00 -2.10 0.00 0.00 70.33 68.59 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 -3.03 4.32 0.63 3.22 1.43 -1.26 -5.10 118.68 118.90 1ce8 s LEU 256 Ca 0.45 0.33 -0.10 0.00 -1.03 0.00 0.00 54.13 53.79 1ce8 s LEU 256 Cb 0.38 -2.53 -0.01 0.00 0.03 0.00 0.00 46.19 44.06 1ce8 s LEU 256 CO 0.06 0.28 1.01 0.42 0.23 0.00 0.00 176.35 178.34 1ce8 s THR 257 N -1.29 4.09 0.22 5.49 -4.23 -1.26 -4.79 115.64 113.87 1ce8 s THR 257 Ca 0.26 0.51 -0.07 0.00 -1.18 0.00 0.00 61.69 61.20 1ce8 s THR 257 Cb -0.12 -3.65 0.17 0.00 1.34 0.00 0.00 72.50 70.23 1ce8 s THR 257 CO 0.17 -0.80 1.78 -0.78 -0.54 0.00 0.00 174.62 174.44 1ce8 h ASP 258 N -0.36 0.44 -0.02 3.99 3.58 -1.98 0.35 116.42 122.41 1ce8 h ASP 258 Ca -0.45 0.06 0.04 0.00 0.42 0.00 0.00 57.03 57.10 1ce8 h ASP 258 Cb 1.23 -0.01 -0.05 0.00 1.72 0.00 0.00 39.33 42.21 1ce8 h ASP 258 CO 0.62 0.25 -0.31 0.11 -2.88 0.00 0.00 179.24 177.03 1ce8 h LYS 259 N 0.58 -0.44 -0.55 0.28 1.57 -1.99 0.70 116.57 116.73 1ce8 h LYS 259 Ca 0.34 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 1ce8 h LYS 259 Cb 0.35 0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.73 1ce8 h LYS 259 CO -0.26 -0.29 0.36 0.93 -0.57 0.00 0.00 179.45 179.62 1ce8 h GLU 260 N -0.45 0.73 -0.37 3.15 5.08 -1.75 -1.32 114.58 119.64 1ce8 h GLU 260 Ca 0.07 -0.05 0.06 0.00 -1.00 0.00 0.00 59.36 58.44 1ce8 h GLU 260 Cb 0.55 -0.16 -0.05 0.00 0.50 0.00 0.00 28.75 29.58 1ce8 h GLU 260 CO -0.28 0.49 0.05 -0.92 -1.00 0.00 0.00 179.01 177.35 1ce8 h TYR 261 N 0.75 0.07 -0.49 4.33 5.03 0.99 -0.14 116.97 127.51 1ce8 h TYR 261 Ca 0.20 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.50 1ce8 h TYR 261 Cb -0.08 0.03 -0.02 0.00 1.55 0.00 0.00 36.73 38.20 1ce8 h TYR 261 CO -0.03 -0.02 0.14 1.96 -1.32 0.00 0.00 178.16 178.89 1ce8 h GLN 262 N 0.16 0.72 -0.33 1.82 1.08 0.74 0.20 115.11 119.50 1ce8 h GLN 262 Ca 0.18 -0.12 -0.00 0.00 -1.45 0.00 0.00 58.65 57.25 1ce8 h GLN 262 Cb 0.23 -0.12 -0.02 0.00 -0.05 0.00 0.00 27.48 27.52 1ce8 h GLN 262 CO -0.26 0.63 0.19 0.82 -0.95 0.00 0.00 178.83 179.27 1ce8 h ILE 263 N 0.70 1.12 -0.62 2.54 2.04 -0.30 0.23 117.51 123.22 1ce8 h ILE 263 Ca 0.16 -0.30 -0.07 0.00 1.00 0.00 0.00 64.86 65.65 1ce8 h ILE 263 Cb 0.22 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 1ce8 h ILE 263 CO -0.01 0.12 0.10 -0.03 0.00 0.00 0.00 178.15 178.34 1ce8 h MET 264 N 0.42 1.01 -0.08 2.37 4.05 -0.37 -0.93 114.93 121.39 1ce8 h MET 264 Ca 0.12 -0.26 -0.00 0.00 -0.28 0.00 0.00 59.70 59.28 1ce8 h MET 264 Cb 0.03 -0.13 -0.00 0.00 -0.80 0.00 0.00 31.60 30.70 1ce8 h MET 264 CO -0.02 0.93 0.04 -0.09 0.23 0.00 0.00 176.91 178.01 1ce8 h ARG 265 N 0.95 0.12 -0.40 0.39 2.43 -0.21 -1.46 114.38 116.21 1ce8 h ARG 265 Ca 0.19 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.41 1ce8 h ARG 265 Cb 0.41 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.88 1ce8 h ARG 265 CO 0.01 0.17 0.07 -0.91 -1.51 0.00 0.00 179.97 177.80 1ce8 h ASN 266 N 0.04 -0.00 -0.47 -3.80 -0.26 -0.20 -2.30 115.58 108.58 1ce8 h ASN 266 Ca 0.03 0.07 0.05 0.00 -0.56 0.00 0.00 56.30 55.89 1ce8 h ASN 266 Cb 0.09 0.09 -0.05 0.00 -1.06 0.00 0.00 38.32 37.39 1ce8 h ASN 266 CO -0.00 0.04 0.20 0.00 -1.06 0.00 0.00 177.43 176.60 1ce8 h ALA 267 N 1.30 0.58 -0.97 -0.83 0.00 -0.96 0.48 119.26 118.86 1ce8 h ALA 267 Ca 0.19 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.19 1ce8 h ALA 267 Cb 0.23 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.94 1ce8 h ALA 267 CO -0.25 -0.17 0.63 0.77 0.00 0.00 0.00 179.25 180.22 1ce8 h SER 268 N 0.40 1.02 -0.09 0.00 0.02 -0.89 0.49 113.55 114.51 1ce8 h SER 268 Ca 0.21 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 61.05 1ce8 h SER 268 Cb 0.17 -0.22 0.01 0.00 0.14 0.00 0.00 62.40 62.50 1ce8 h SER 268 CO -0.19 0.67 -0.42 0.24 -1.14 0.00 0.00 176.83 176.00 1ce8 h MET 269 N 1.17 0.44 -0.93 3.45 2.86 -0.93 -2.95 114.93 118.04 1ce8 h MET 269 Ca 0.41 -0.36 0.12 0.00 -2.06 0.00 0.00 59.70 57.81 1ce8 h MET 269 Cb 0.10 0.07 -0.07 0.00 0.06 0.00 0.00 31.60 31.76 1ce8 h MET 269 CO -0.15 0.99 0.60 0.00 1.06 0.00 0.00 176.91 179.40 1ce8 h ALA 270 N 0.46 1.67 0.18 6.32 0.00 -0.36 -2.00 119.26 125.53 1ce8 h ALA 270 Ca -0.03 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1ce8 h ALA 270 Cb 1.06 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1ce8 h ALA 270 CO 0.09 0.11 -0.09 0.28 0.00 0.00 0.00 179.25 179.64 1ce8 h VAL 271 N 0.85 0.86 -0.87 0.00 2.07 0.11 -2.10 116.25 117.18 1ce8 h VAL 271 Ca 0.46 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.81 1ce8 h VAL 271 Cb 0.55 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 31.25 1ce8 h VAL 271 CO -0.22 0.04 0.54 -0.07 0.02 0.00 0.00 177.57 177.88 1ce8 h LEU 272 N -0.32 1.03 -0.49 2.57 4.07 -1.30 -1.35 115.31 119.52 1ce8 h LEU 272 Ca -0.02 -0.05 0.03 0.00 0.08 0.00 0.00 57.88 57.91 1ce8 h LEU 272 Cb 0.25 -0.26 -0.04 0.00 1.08 0.00 0.00 40.66 41.69 1ce8 h LEU 272 CO 0.04 0.78 0.28 0.03 -1.08 0.00 0.00 178.44 178.48 1ce8 h ARG 273 N 1.19 0.54 -0.17 1.13 3.08 -1.28 0.95 114.38 119.81 1ce8 h ARG 273 Ca 0.31 -0.03 -0.16 0.00 0.07 0.00 0.00 59.98 60.17 1ce8 h ARG 273 Cb -0.08 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 1ce8 h ARG 273 CO -0.06 0.35 -0.55 1.49 -1.07 0.00 0.00 179.97 180.13 1ce8 h GLU 274 N 0.55 0.51 -0.08 0.04 4.57 -1.04 -3.05 114.58 116.08 1ce8 h GLU 274 Ca 0.21 -0.32 -0.12 0.00 -1.18 0.00 0.00 59.36 57.94 1ce8 h GLU 274 Cb 0.06 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 1ce8 h GLU 274 CO -0.11 0.93 -0.50 0.82 -1.18 0.00 0.00 179.01 178.96 1ce8 h ILE 275 N 0.39 1.35 0.00 2.32 5.03 -0.84 -3.47 117.51 122.29 1ce8 h ILE 275 Ca 0.01 -1.74 0.00 0.00 -0.12 0.00 0.00 64.86 63.01 1ce8 h ILE 275 Cb 1.08 1.85 0.00 0.00 -3.03 0.00 0.00 36.82 36.72 1ce8 h ILE 275 CO 0.10 0.51 0.00 0.61 -0.68 0.00 0.00 178.15 178.69 1ce8 n GLY 276 N 0.01 1.72 3.40 5.37 0.00 0.24 -4.34 105.19 111.60 1ce8 n GLY 276 Ca -0.02 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.56 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 5.00 -0.10 1.61 1.01 -0.67 -4.61 120.40 120.64 1ce8 s VAL 277 Ca 0.00 -0.84 0.13 0.00 0.00 0.00 0.00 61.98 61.28 1ce8 s VAL 277 Cb 0.00 -4.28 -0.19 0.00 0.00 0.00 0.00 36.38 31.90 1ce8 s VAL 277 CO 0.00 -0.80 0.14 -0.62 0.00 0.00 0.00 175.10 173.82 1ce8 n GLU 278 N 5.83 1.32 -2.95 2.72 1.02 -1.26 -4.60 120.64 122.71 1ce8 n GLU 278 Ca -0.09 -0.05 -0.24 0.00 -0.02 0.00 0.00 57.16 56.76 1ce8 n GLU 278 Cb 0.44 -1.36 -0.03 0.00 -0.02 0.00 0.00 31.44 30.47 1ce8 n GLU 278 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1ce8 n THR 279 N -2.37 2.03 -3.39 2.62 -2.24 -1.26 -2.36 114.28 107.31 1ce8 n THR 279 Ca -0.17 -5.14 0.00 0.00 -2.27 0.00 0.00 64.05 56.47 1ce8 n THR 279 Cb 0.79 -0.98 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 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 -0.12 -0.98 3.75 3.38 0.00 -0.21 -3.63 105.19 107.39 1ce8 n GLY 280 Ca 0.29 -0.90 -0.23 0.00 0.00 0.00 0.00 46.02 45.19 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 0.00 1.52 -0.01 -0.02 0.00 -1.26 -0.46 107.32 107.09 1ce8 s GLY 281 Ca 0.00 -1.49 -0.24 0.00 0.00 0.00 0.00 44.72 42.99 1ce8 s GLY 281 CO 0.00 -1.54 0.53 -0.56 0.00 0.00 0.00 173.10 171.53 1ce8 s SER 282 N -3.71 -0.46 -0.25 1.64 0.01 0.29 -3.46 113.70 107.76 1ce8 s SER 282 Ca 0.32 0.39 -0.10 0.00 1.31 0.00 0.00 55.95 57.87 1ce8 s SER 282 Cb -0.07 0.46 -0.05 0.00 0.21 0.00 0.00 66.02 66.57 1ce8 s SER 282 CO 0.23 -0.59 0.15 0.21 0.41 0.00 0.00 173.24 173.65 1ce8 s ASN 283 N -1.43 5.89 -0.13 2.44 3.84 -0.72 -0.67 114.94 124.15 1ce8 s ASN 283 Ca -0.10 0.02 -0.01 0.00 0.21 0.00 0.00 52.86 52.98 1ce8 s ASN 283 Cb -0.02 -2.07 -0.02 0.00 -0.55 0.00 0.00 41.25 38.60 1ce8 s ASN 283 CO 0.05 0.02 -0.12 -0.69 -2.79 0.00 0.00 177.10 173.58 1ce8 s VAL 284 N 1.31 3.18 -0.10 -5.21 1.01 -0.53 -0.74 120.40 119.33 1ce8 s VAL 284 Ca 0.07 -0.61 -0.03 0.00 0.00 0.00 0.00 61.98 61.41 1ce8 s VAL 284 Cb -0.14 -2.35 -0.03 0.00 0.00 0.00 0.00 36.38 33.86 1ce8 s VAL 284 CO 0.06 0.52 0.00 -1.10 0.00 0.00 0.00 175.10 174.59 1ce8 s GLN 285 N 0.35 3.13 0.27 2.72 -0.21 -0.25 -1.52 119.66 124.15 1ce8 s GLN 285 Ca -0.10 -0.41 0.04 0.00 0.02 0.00 0.00 55.36 54.91 1ce8 s GLN 285 Cb -0.16 -2.84 -0.06 0.00 1.00 0.00 0.00 33.01 30.95 1ce8 s GLN 285 CO 0.05 0.63 0.02 -0.06 -2.12 0.00 0.00 175.29 173.81 1ce8 s PHE 286 N -0.67 1.73 -0.10 0.91 0.40 1.00 -1.12 117.98 120.14 1ce8 s PHE 286 Ca 0.11 -0.92 0.01 0.00 -0.60 0.00 0.00 56.93 55.52 1ce8 s PHE 286 Cb -0.12 -1.05 0.02 0.00 0.51 0.00 0.00 43.02 42.39 1ce8 s PHE 286 CO 0.02 -0.01 -0.11 0.00 0.70 0.00 0.00 175.22 175.83 1ce8 s ALA 287 N -3.36 1.39 -0.09 5.36 0.00 0.12 -2.14 121.76 123.05 1ce8 s ALA 287 Ca 0.32 -0.55 0.04 0.00 0.00 0.00 0.00 51.96 51.77 1ce8 s ALA 287 Cb 0.06 -0.78 -0.00 0.00 0.00 0.00 0.00 23.12 22.40 1ce8 s ALA 287 CO 0.12 -0.17 -0.24 0.08 0.00 0.00 0.00 175.76 175.55 1ce8 s VAL 288 N 1.21 2.03 -0.61 0.00 1.01 0.19 -1.51 120.40 122.71 1ce8 s VAL 288 Ca -0.04 -1.01 -0.27 0.00 0.00 0.00 0.00 61.98 60.66 1ce8 s VAL 288 Cb -0.14 -1.74 0.04 0.00 0.00 0.00 0.00 36.38 34.53 1ce8 s VAL 288 CO -0.03 0.55 1.13 0.21 0.00 0.00 0.00 175.10 176.97 1ce8 s ASN 289 N 0.23 6.35 0.56 3.32 3.84 -0.39 -0.79 114.94 128.05 1ce8 s ASN 289 Ca -0.15 -0.17 0.34 0.00 0.21 0.00 0.00 52.86 53.09 1ce8 s ASN 289 Cb -0.17 -2.52 1.49 0.00 -0.55 0.00 0.00 41.25 39.50 1ce8 s ASN 289 CO 0.08 -1.48 1.79 1.55 -2.79 0.00 0.00 177.10 176.25 1ce8 h PRO 290 N 9.58 0.00 0.00 0.43 0.13 -1.91 1.39 132.00 141.61 1ce8 h PRO 290 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1ce8 h PRO 290 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1ce8 h PRO 290 CO 1.18 0.00 0.00 0.87 -0.23 0.00 0.00 178.00 179.82 1ce8 h LYS 291 N 0.00 0.00 0.00 0.86 1.57 -1.99 -3.38 116.57 113.63 1ce8 h LYS 291 Ca 0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 1ce8 h LYS 291 Cb 2.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.37 1ce8 h LYS 291 CO -0.01 0.00 0.00 0.27 -0.57 0.00 0.00 179.45 179.14 1ce8 n ASN 292 N -2.67 0.00 0.00 0.86 0.23 0.01 -5.00 115.26 108.69 1ce8 n ASN 292 Ca 0.05 -1.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.10 1ce8 n ASN 292 Cb 0.47 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.17 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 0.00 0.12 3.67 4.83 0.00 0.46 -4.90 105.19 109.37 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 -0.06 1.77 -3.28 1.61 0.63 -1.23 -4.62 116.66 111.47 1ce8 n ARG 294 Ca 0.00 0.63 -0.39 0.00 -0.92 0.00 0.00 57.85 57.18 1ce8 n ARG 294 Cb 0.36 -2.48 -0.06 0.00 0.45 0.00 0.00 32.46 30.73 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 4.31 4.20 -0.06 6.15 2.96 -1.26 -1.27 118.68 133.71 1ce8 s LEU 295 Ca 0.96 0.72 0.02 0.00 -0.22 0.00 0.00 54.13 55.61 1ce8 s LEU 295 Cb -0.82 -2.69 0.02 0.00 0.50 0.00 0.00 46.19 43.20 1ce8 s LEU 295 CO 0.56 -0.10 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.76 1ce8 s ILE 296 N 1.22 0.96 -0.04 6.68 1.01 -0.57 -4.36 121.20 126.10 1ce8 s ILE 296 Ca 0.24 -0.36 -0.24 0.00 0.00 0.00 0.00 60.65 60.29 1ce8 s ILE 296 Cb -0.15 -0.91 -0.04 0.00 0.01 0.00 0.00 42.46 41.37 1ce8 s ILE 296 CO 0.10 0.32 0.74 -0.69 0.00 0.00 0.00 174.94 175.41 1ce8 s VAL 297 N 0.86 4.97 -0.23 2.92 1.01 0.27 0.14 120.40 130.34 1ce8 s VAL 297 Ca -0.11 1.53 -0.12 0.00 0.00 0.00 0.00 61.98 63.28 1ce8 s VAL 297 Cb -0.15 -4.08 -0.10 0.00 0.00 0.00 0.00 36.38 32.05 1ce8 s VAL 297 CO 0.01 0.27 -0.31 -0.38 0.00 0.00 0.00 175.10 174.69 1ce8 n ILE 298 N 3.59 1.31 -3.79 2.22 2.08 -0.27 -4.56 119.36 119.95 1ce8 n ILE 298 Ca -0.01 -0.31 -0.02 0.00 0.56 0.00 0.00 62.75 62.97 1ce8 n ILE 298 Cb 0.51 -1.85 -0.00 0.00 -0.75 0.00 0.00 39.64 37.56 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 -2.45 1.09 -0.02 0.38 -1.05 -1.22 -5.01 118.70 110.41 1ce8 s GLU 299 Ca -0.33 -0.64 -0.03 0.00 -0.15 0.00 0.00 54.97 53.82 1ce8 s GLU 299 Cb 0.12 0.34 0.00 0.00 -0.44 0.00 0.00 34.13 34.16 1ce8 s GLU 299 CO 0.42 -0.50 0.08 0.00 0.95 0.00 0.00 175.26 176.20 1ce8 s MET 300 N -2.72 0.19 -0.27 -4.83 0.23 -1.26 -1.09 119.30 109.55 1ce8 s MET 300 Ca 0.16 -0.07 0.02 0.00 -1.03 0.00 0.00 55.69 54.77 1ce8 s MET 300 Cb -0.01 0.08 0.06 0.00 -1.53 0.00 0.00 34.83 33.44 1ce8 s MET 300 CO 0.02 -0.03 -0.09 -0.80 -2.03 0.00 0.00 175.02 172.09 1ce8 s ASN 301 N -0.41 4.52 -0.21 -1.18 0.01 0.08 -4.73 114.94 113.03 1ce8 s ASN 301 Ca -0.05 -1.42 -0.04 0.00 -0.71 0.00 0.00 52.86 50.64 1ce8 s ASN 301 Cb -0.03 -1.58 -0.14 0.00 0.41 0.00 0.00 41.25 39.92 1ce8 s ASN 301 CO 0.00 -0.21 2.31 -0.81 -1.51 0.00 0.00 177.10 176.88 1ce8 n PRO 302 N 4.45 1.40 -4.00 -0.60 -0.04 -1.26 -1.75 135.00 133.19 1ce8 n PRO 302 Ca -0.13 -0.79 0.04 0.00 -0.04 0.00 0.00 63.50 62.58 1ce8 n PRO 302 Cb 0.42 -1.94 0.01 0.00 -0.04 0.00 0.00 33.50 31.95 1ce8 n PRO 302 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1ce8 s ARG 303 N 2.14 0.24 0.78 0.54 1.70 -1.22 -4.88 118.95 118.24 1ce8 s ARG 303 Ca 0.40 -0.15 -0.11 0.00 -0.47 0.00 0.00 55.73 55.40 1ce8 s ARG 303 Cb 0.17 0.07 0.06 0.00 -0.57 0.00 0.00 34.95 34.68 1ce8 s ARG 303 CO -0.01 -0.11 1.09 0.14 -1.08 0.00 0.00 175.30 175.33 1ce8 s VAL 304 N -2.02 3.31 0.00 4.99 -7.23 -0.99 -4.26 120.40 114.21 1ce8 s VAL 304 Ca 0.30 0.43 0.00 0.00 -1.81 0.00 0.00 61.98 60.90 1ce8 s VAL 304 Cb -0.00 -2.92 0.00 0.00 0.56 0.00 0.00 36.38 34.02 1ce8 s VAL 304 CO -0.02 -0.56 0.00 -1.54 -0.31 0.00 0.00 175.10 172.68 1ce8 n SER 305 N -3.53 0.00 0.06 4.85 3.41 -1.26 -4.71 113.62 112.44 1ce8 n SER 305 Ca 0.09 -0.93 -0.05 0.00 -0.26 0.00 0.00 58.87 57.71 1ce8 n SER 305 Cb 0.53 0.00 0.13 0.00 -0.26 0.00 0.00 64.21 64.61 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 0.34 -0.09 4.33 0.11 -1.95 -1.79 114.38 115.32 1ce8 h ARG 306 Ca 0.00 -0.20 -0.16 0.00 0.10 0.00 0.00 59.98 59.72 1ce8 h ARG 306 Cb 0.00 0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.09 1ce8 h ARG 306 CO 0.00 0.78 -0.63 0.77 0.10 0.00 0.00 179.97 180.98 1ce8 h SER 307 N 0.26 0.39 -0.39 0.08 0.02 -1.99 -2.09 113.55 109.84 1ce8 h SER 307 Ca 0.01 -0.23 -0.11 0.00 -0.84 0.00 0.00 61.79 60.62 1ce8 h SER 307 Cb 1.01 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.41 1ce8 h SER 307 CO 0.09 0.92 -0.15 0.77 -1.14 0.00 0.00 176.83 177.32 1ce8 h SER 308 N 0.25 0.86 -0.26 3.07 4.64 -1.88 0.26 113.55 120.48 1ce8 h SER 308 Ca -0.01 -0.29 -0.14 0.00 -0.47 0.00 0.00 61.79 60.89 1ce8 h SER 308 Cb 1.17 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 63.01 1ce8 h SER 308 CO 0.10 1.01 -0.33 0.00 -0.87 0.00 0.00 176.83 176.75 1ce8 h ALA 309 N 1.06 0.76 -0.20 5.18 0.00 -1.22 0.15 119.26 124.99 1ce8 h ALA 309 Ca 0.12 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 1ce8 h ALA 309 Cb 0.67 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1ce8 h ALA 309 CO 0.05 0.66 0.03 1.25 0.00 0.00 0.00 179.25 181.23 1ce8 h LEU 310 N 0.66 0.31 -0.56 0.00 5.85 -1.12 -1.38 115.31 119.07 1ce8 h LEU 310 Ca 0.07 -0.26 0.05 0.00 0.84 0.00 0.00 57.88 58.57 1ce8 h LEU 310 Cb 0.87 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.77 1ce8 h LEU 310 CO 0.08 0.50 0.29 0.00 -0.34 0.00 0.00 178.44 178.97 1ce8 h ALA 311 N 0.83 0.73 -0.86 1.25 0.00 -0.26 0.48 119.26 121.43 1ce8 h ALA 311 Ca 0.06 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1ce8 h ALA 311 Cb 0.32 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1ce8 h ALA 311 CO 0.00 -0.04 0.45 0.77 0.00 0.00 0.00 179.25 180.44 1ce8 h SER 312 N 0.56 1.09 -0.01 0.00 0.02 -0.55 0.84 113.55 115.50 1ce8 h SER 312 Ca 0.25 -0.11 -0.19 0.00 -0.84 0.00 0.00 61.79 60.90 1ce8 h SER 312 Cb 0.14 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.41 1ce8 h SER 312 CO -0.16 0.89 -0.66 0.11 -1.14 0.00 0.00 176.83 175.87 1ce8 h LYS 313 N 1.21 0.63 -0.21 3.45 1.79 -0.62 0.31 116.57 123.13 1ce8 h LYS 313 Ca 0.30 -0.46 -0.11 0.00 -2.18 0.00 0.00 60.65 58.20 1ce8 h LYS 313 Cb 0.06 0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.77 1ce8 h LYS 313 CO -0.05 1.08 -0.36 0.00 -1.08 0.00 0.00 179.45 179.04 1ce8 h ALA 314 N 0.81 1.00 0.00 3.86 0.00 0.45 -3.34 119.26 122.04 1ce8 h ALA 314 Ca -0.02 -0.40 -0.30 0.00 0.00 0.00 0.00 54.91 54.19 1ce8 h ALA 314 Cb 1.24 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.87 1ce8 h ALA 314 CO 0.13 0.60 -2.14 0.25 0.00 0.00 0.00 179.25 178.09 1ce8 n THR 315 N -4.06 1.14 -0.08 0.00 -2.24 0.24 -4.98 114.28 104.30 1ce8 n THR 315 Ca -0.01 -0.67 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 1ce8 n THR 315 Cb 0.47 -0.65 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 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 2.05 0.87 3.42 3.38 0.00 0.09 -2.36 105.19 112.64 1ce8 n GLY 316 Ca -0.28 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.04 3.05 -0.90 1.61 2.19 -1.19 -4.64 117.98 116.06 1ce8 s PHE 317 Ca 0.00 -0.70 -0.23 0.00 0.33 0.00 0.00 56.93 56.33 1ce8 s PHE 317 Cb 0.00 -3.67 -0.14 0.00 -1.31 0.00 0.00 43.02 37.90 1ce8 s PHE 317 CO 0.00 -1.10 1.91 -0.35 1.83 0.00 0.00 175.22 177.51 1ce8 n PRO 318 N 6.16 1.44 -0.36 10.12 -0.04 -1.26 -4.19 135.00 146.87 1ce8 n PRO 318 Ca -0.08 -2.05 -0.09 0.00 -0.04 0.00 0.00 63.50 61.23 1ce8 n PRO 318 Cb 0.44 -3.24 -0.07 0.00 -0.04 0.00 0.00 33.50 30.59 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 5.22 0.01 -0.84 0.52 2.04 -1.92 -2.00 117.51 120.54 1ce8 h ILE 319 Ca 0.33 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.22 1ce8 h ILE 319 Cb 0.78 0.01 -0.05 0.00 -0.74 0.00 0.00 36.82 36.82 1ce8 h ILE 319 CO 1.65 0.00 0.55 0.00 0.00 0.00 0.00 178.15 180.36 1ce8 h ALA 320 N 0.61 1.50 -0.17 1.87 0.00 -1.92 -0.57 119.26 120.58 1ce8 h ALA 320 Ca 0.19 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1ce8 h ALA 320 Cb 0.48 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1ce8 h ALA 320 CO -0.88 0.42 0.05 0.87 0.00 0.00 0.00 179.25 179.71 1ce8 h LYS 321 N 1.03 0.27 0.43 0.00 1.57 -1.61 -1.72 116.57 116.53 1ce8 h LYS 321 Ca 0.34 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 59.04 1ce8 h LYS 321 Cb 0.05 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1ce8 h LYS 321 CO -0.10 0.38 -0.21 0.28 -0.57 0.00 0.00 179.45 179.23 1ce8 h VAL 322 N 0.10 0.58 -0.44 0.50 2.07 -1.16 -3.00 116.25 114.90 1ce8 h VAL 322 Ca 0.06 -0.09 0.07 0.00 0.82 0.00 0.00 66.70 67.56 1ce8 h VAL 322 Cb 0.22 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1ce8 h VAL 322 CO -0.00 0.02 0.30 0.00 0.02 0.00 0.00 177.57 177.91 1ce8 h ALA 323 N -0.08 2.06 -0.08 1.67 0.00 -1.08 -0.65 119.26 121.10 1ce8 h ALA 323 Ca -0.06 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1ce8 h ALA 323 Cb 0.47 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1ce8 h ALA 323 CO 0.10 -0.15 -0.30 0.00 0.00 0.00 0.00 179.25 178.90 1ce8 h ALA 324 N 1.77 1.36 0.19 0.00 0.00 -1.17 -1.02 119.26 120.39 1ce8 h ALA 324 Ca 0.20 -0.31 -0.31 0.00 0.00 0.00 0.00 54.91 54.49 1ce8 h ALA 324 Cb 0.43 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.17 1ce8 h ALA 324 CO -0.04 0.45 -1.41 0.87 0.00 0.00 0.00 179.25 179.13 1ce8 h LYS 325 N 0.13 0.41 -0.40 0.00 1.57 -1.10 -3.21 116.57 113.97 1ce8 h LYS 325 Ca 0.02 -0.70 -0.01 0.00 -1.87 0.00 0.00 60.65 58.09 1ce8 h LYS 325 Cb 0.60 0.26 -0.02 0.00 0.08 0.00 0.00 32.23 33.15 1ce8 h LYS 325 CO 0.04 1.33 0.20 -0.07 -0.57 0.00 0.00 179.45 180.38 1ce8 h LEU 326 N 0.11 0.50 -1.93 2.94 3.38 -0.88 -0.80 115.31 118.63 1ce8 h LEU 326 Ca -0.21 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 1ce8 h LEU 326 Cb 2.08 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 42.70 1ce8 h LEU 326 CO 0.24 0.43 -0.12 0.00 0.09 0.00 0.00 178.44 179.07 1ce8 h ALA 327 N 1.66 1.35 -0.62 1.53 0.00 -1.19 -2.34 119.26 119.64 1ce8 h ALA 327 Ca 0.14 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 1ce8 h ALA 327 Cb 0.06 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 1ce8 h ALA 327 CO -0.02 0.15 0.11 1.33 0.00 0.00 0.00 179.25 180.82 1ce8 n VAL 328 N -3.74 2.73 -0.27 0.00 0.24 -0.37 -4.32 118.33 112.61 1ce8 n VAL 328 Ca -0.02 -1.43 0.00 0.00 -2.04 0.00 0.00 64.34 60.85 1ce8 n VAL 328 Cb 0.23 -0.33 0.00 0.00 -1.47 0.00 0.00 33.84 32.27 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 0.30 0.77 3.80 7.63 0.00 -0.88 -1.07 105.19 115.74 1ce8 n GLY 329 Ca 0.32 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.62 2.87 0.23 1.61 1.51 -0.83 -4.27 117.35 115.84 1ce8 s TYR 330 Ca 0.00 1.34 0.11 0.00 -1.01 0.00 0.00 57.07 57.52 1ce8 s TYR 330 Cb 0.00 -3.01 -0.05 0.00 -0.11 0.00 0.00 41.96 38.80 1ce8 s TYR 330 CO 0.00 -1.60 -0.21 0.95 -1.11 0.00 0.00 175.55 173.58 1ce8 s THR 331 N -3.05 2.47 0.32 -0.71 -4.23 -1.25 -4.34 115.64 104.86 1ce8 s THR 331 Ca 0.60 -2.16 0.06 0.00 -1.18 0.00 0.00 61.69 59.01 1ce8 s THR 331 Cb -0.15 -2.24 0.31 0.00 1.34 0.00 0.00 72.50 71.76 1ce8 s THR 331 CO 0.55 -0.24 1.81 -0.07 -0.54 0.00 0.00 174.62 176.14 1ce8 h LEU 332 N 2.78 0.77 -1.45 4.79 3.38 -1.93 -0.21 115.31 123.44 1ce8 h LEU 332 Ca -0.44 0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.55 1ce8 h LEU 332 Cb 1.23 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 1ce8 h LEU 332 CO 0.53 0.33 -0.25 -2.24 0.09 0.00 0.00 178.44 176.91 1ce8 h ASP 333 N 0.78 0.00 1.32 -0.43 2.03 -1.92 -1.95 116.42 116.25 1ce8 h ASP 333 Ca 0.53 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.83 1ce8 h ASP 333 Cb 0.80 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.30 1ce8 h ASP 333 CO -0.30 0.25 -0.53 -0.33 -1.03 0.00 0.00 179.24 177.29 1ce8 h GLU 334 N 0.00 0.00 -6.27 4.15 5.08 -1.45 -3.45 114.58 112.63 1ce8 h GLU 334 Ca -0.00 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.79 1ce8 h GLU 334 Cb 0.57 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 1ce8 h GLU 334 CO 0.03 0.00 -0.05 -0.51 -1.00 0.00 0.00 179.01 177.48 1ce8 s LEU 335 N -5.34 4.46 0.17 1.33 1.43 -1.04 -5.00 118.68 114.70 1ce8 s LEU 335 Ca 0.04 1.20 -0.08 0.00 -1.03 0.00 0.00 54.13 54.27 1ce8 s LEU 335 Cb 0.09 -3.04 -0.06 0.00 0.03 0.00 0.00 46.19 43.21 1ce8 s LEU 335 CO 0.72 0.21 0.46 -0.04 0.23 0.00 0.00 176.35 177.93 1ce8 s MET 336 N -1.42 3.72 -0.37 1.70 -1.94 -1.26 0.28 119.30 120.00 1ce8 s MET 336 Ca 0.32 0.11 -0.27 0.00 -1.71 0.00 0.00 55.69 54.14 1ce8 s MET 336 Cb -0.18 -2.78 0.02 0.00 2.01 0.00 0.00 34.83 33.90 1ce8 s MET 336 CO 0.19 0.41 1.01 1.21 -0.01 0.00 0.00 175.02 177.83 1ce8 s ASN 337 N -2.31 6.75 0.15 3.03 2.47 0.69 -4.45 114.94 121.27 1ce8 s ASN 337 Ca 0.43 0.71 -0.26 0.00 0.42 0.00 0.00 52.86 54.16 1ce8 s ASN 337 Cb -0.12 -2.50 -0.00 0.00 -1.45 0.00 0.00 41.25 37.17 1ce8 s ASN 337 CO 0.22 -0.93 1.60 0.44 -3.72 0.00 0.00 177.10 174.71 1ce8 h ASP 338 N 8.48 -1.14 0.69 -4.21 5.19 -1.91 -1.35 116.42 122.18 1ce8 h ASP 338 Ca -0.22 0.17 0.00 0.00 -0.62 0.00 0.00 57.03 56.36 1ce8 h ASP 338 Cb 1.07 0.49 0.00 0.00 0.18 0.00 0.00 39.33 41.07 1ce8 h ASP 338 CO 1.02 -0.36 0.00 2.30 -3.12 0.00 0.00 179.24 179.08 1ce8 n ILE 339 N -5.42 0.57 -1.43 0.35 -5.35 -1.26 -2.89 119.36 103.92 1ce8 n ILE 339 Ca -0.02 0.14 -0.22 0.00 -0.27 0.00 0.00 62.75 62.38 1ce8 n ILE 339 Cb 0.34 -0.79 0.13 0.00 -1.74 0.00 0.00 39.64 37.59 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 -1.49 3.08 -2.03 7.28 -2.24 -1.16 -3.94 114.28 113.78 1ce8 n THR 340 Ca 0.05 -2.76 -0.16 0.00 -2.27 0.00 0.00 64.05 58.91 1ce8 n THR 340 Cb 0.24 -0.73 -0.03 0.00 -2.10 0.00 0.00 70.33 67.70 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 -1.02 0.36 2.80 3.38 0.00 -1.14 -1.96 105.19 107.60 1ce8 n GLY 341 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.54 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 -0.65 2.37 0.29 -0.02 0.00 -0.52 -4.90 105.19 101.76 1ce8 n GLY 342 Ca -0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 45.95 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 2.37 0.00 -6.04 1.61 -0.00 -1.62 -3.42 114.38 107.28 1ce8 h ARG 343 Ca 0.00 0.00 -0.58 0.00 -0.50 0.00 0.00 59.98 58.90 1ce8 h ARG 343 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 29.97 29.83 1ce8 h ARG 343 CO 0.00 0.00 -0.74 0.95 0.00 0.00 0.00 179.97 180.18 1ce8 s THR 344 N -4.95 2.29 0.62 2.04 -4.23 -1.26 -5.02 115.64 105.13 1ce8 s THR 344 Ca -0.05 -2.34 -0.05 0.00 -1.18 0.00 0.00 61.69 58.07 1ce8 s THR 344 Cb 0.17 -2.30 0.03 0.00 1.34 0.00 0.00 72.50 71.74 1ce8 s THR 344 CO 0.65 -0.41 0.92 -2.16 -0.54 0.00 0.00 174.62 173.07 1ce8 s PRO 345 N -3.55 2.57 0.17 3.99 0.04 -1.26 -0.22 135.00 136.74 1ce8 s PRO 345 Ca 0.29 -0.25 0.24 0.00 0.04 0.00 0.00 61.00 61.32 1ce8 s PRO 345 Cb -0.03 -2.28 0.91 0.00 0.04 0.00 0.00 34.50 33.14 1ce8 s PRO 345 CO 0.14 -0.90 1.73 0.00 0.04 0.00 0.00 177.00 178.00 1ce8 n ALA 346 N -2.66 1.96 -2.57 8.56 0.00 0.14 -4.24 120.51 121.70 1ce8 n ALA 346 Ca 0.06 0.01 -0.42 0.00 0.00 0.00 0.00 53.44 53.08 1ce8 n ALA 346 Cb 0.59 -1.40 -0.01 0.00 0.00 0.00 0.00 19.45 18.63 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 -4.01 6.73 -0.02 0.00 1.04 -0.76 -4.86 113.70 111.83 1ce8 s SER 347 Ca 0.08 -2.14 -0.30 0.00 0.48 0.00 0.00 55.95 54.07 1ce8 s SER 347 Cb 0.12 -2.58 0.11 0.00 0.10 0.00 0.00 66.02 63.77 1ce8 s SER 347 CO 0.46 -1.28 1.20 0.72 0.98 0.00 0.00 173.24 175.33 1ce8 s PHE 348 N 4.46 -0.08 -0.22 5.02 -0.71 -1.26 -4.95 117.98 120.23 1ce8 s PHE 348 Ca 0.51 -0.04 -0.05 0.00 -1.04 0.00 0.00 56.93 56.31 1ce8 s PHE 348 Cb 0.03 0.56 -0.02 0.00 -1.21 0.00 0.00 43.02 42.37 1ce8 s PHE 348 CO 0.02 -0.37 0.00 -1.21 -1.34 0.00 0.00 175.22 172.33 1ce8 s GLU 349 N -2.60 3.54 0.65 1.99 2.02 -1.26 -4.75 118.70 118.29 1ce8 s GLU 349 Ca 0.13 -0.55 -0.18 0.00 0.02 0.00 0.00 54.97 54.39 1ce8 s GLU 349 Cb 0.03 -3.12 -0.01 0.00 0.10 0.00 0.00 34.13 31.13 1ce8 s GLU 349 CO -0.03 -0.12 1.25 -2.14 0.02 0.00 0.00 175.26 174.24 1ce8 s PRO 350 N 1.33 2.57 -0.05 0.39 0.02 -1.26 -5.01 135.00 132.99 1ce8 s PRO 350 Ca 0.04 1.93 -0.00 0.00 0.02 0.00 0.00 61.00 62.98 1ce8 s PRO 350 Cb -0.15 -1.87 0.03 0.00 0.02 0.00 0.00 34.50 32.54 1ce8 s PRO 350 CO 0.01 -1.55 -0.00 0.45 -0.33 0.00 0.00 177.00 175.58 1ce8 s SER 351 N -1.60 1.09 0.02 2.53 0.15 0.42 -4.94 113.70 111.36 1ce8 s SER 351 Ca 0.79 -0.06 0.03 0.00 0.70 0.00 0.00 55.95 57.42 1ce8 s SER 351 Cb -0.34 -0.35 -0.03 0.00 -1.71 0.00 0.00 66.02 63.59 1ce8 s SER 351 CO 0.39 -0.15 -0.06 0.27 1.20 0.00 0.00 173.24 174.89 1ce8 s ILE 352 N 1.53 3.69 -0.56 6.45 -4.36 -1.26 0.09 121.20 126.77 1ce8 s ILE 352 Ca -0.02 -0.81 0.03 0.00 -0.26 0.00 0.00 60.65 59.59 1ce8 s ILE 352 Cb -0.13 -2.63 0.41 0.00 1.25 0.00 0.00 42.46 41.36 1ce8 s ILE 352 CO -0.03 0.36 1.46 -0.90 0.24 0.00 0.00 174.94 176.06 1ce8 n ASP 353 N 1.42 5.79 -3.36 4.36 5.75 -1.26 -4.87 116.55 124.38 1ce8 n ASP 353 Ca -0.15 -3.76 -0.05 0.00 -0.01 0.00 0.00 54.79 50.82 1ce8 n ASP 353 Cb 0.52 -0.66 0.01 0.00 -1.03 0.00 0.00 41.12 39.96 1ce8 n ASP 353 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 1ce8 s TYR 354 N -3.73 0.02 -0.08 2.11 -0.85 -1.26 -4.85 117.35 108.71 1ce8 s TYR 354 Ca 0.51 -0.48 0.05 0.00 -0.52 0.00 0.00 57.07 56.62 1ce8 s TYR 354 Cb 0.42 0.73 -0.01 0.00 0.38 0.00 0.00 41.96 43.48 1ce8 s TYR 354 CO -0.22 -1.10 -0.24 0.08 -1.52 0.00 0.00 175.55 172.56 1ce8 s VAL 355 N -2.56 2.13 -0.16 -3.49 1.01 0.84 -4.60 120.40 113.58 1ce8 s VAL 355 Ca 0.17 -1.02 -0.04 0.00 0.00 0.00 0.00 61.98 61.10 1ce8 s VAL 355 Cb -0.03 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 1ce8 s VAL 355 CO 0.06 0.56 -0.03 -0.69 0.00 0.00 0.00 175.10 175.01 1ce8 s VAL 356 N 0.10 3.96 -0.10 2.92 1.01 -0.42 -1.85 120.40 126.04 1ce8 s VAL 356 Ca -0.11 -0.33 0.03 0.00 0.00 0.00 0.00 61.98 61.57 1ce8 s VAL 356 Cb -0.16 -2.74 -0.01 0.00 0.00 0.00 0.00 36.38 33.47 1ce8 s VAL 356 CO 0.06 0.49 -0.21 -0.89 0.00 0.00 0.00 175.10 174.56 1ce8 s THR 357 N 0.34 2.38 -0.05 3.92 2.01 -0.01 -1.57 115.64 122.66 1ce8 s THR 357 Ca -0.03 -0.92 0.06 0.00 0.31 0.00 0.00 61.69 61.11 1ce8 s THR 357 Cb -0.14 -1.93 -0.01 0.00 0.01 0.00 0.00 72.50 70.43 1ce8 s THR 357 CO 0.03 0.55 -0.24 -0.75 -0.69 0.00 0.00 174.62 173.52 1ce8 s LYS 358 N 0.18 2.40 -0.11 4.92 2.36 0.33 -0.51 119.74 129.32 1ce8 s LYS 358 Ca -0.12 -0.88 0.03 0.00 -2.55 0.00 0.00 55.97 52.45 1ce8 s LYS 358 Cb -0.16 -2.08 0.01 0.00 -1.05 0.00 0.00 37.83 34.54 1ce8 s LYS 358 CO 0.07 0.40 -0.20 0.42 1.55 0.00 0.00 175.35 177.58 1ce8 s ILE 359 N -0.22 1.85 0.55 5.43 1.01 -0.51 -1.10 121.20 128.21 1ce8 s ILE 359 Ca -0.01 -0.88 -0.19 0.00 0.00 0.00 0.00 60.65 59.57 1ce8 s ILE 359 Cb -0.13 -1.63 -0.05 0.00 0.01 0.00 0.00 42.46 40.65 1ce8 s ILE 359 CO 0.03 0.51 1.09 -2.16 0.00 0.00 0.00 174.94 174.41 1ce8 s PRO 360 N 0.64 3.40 -0.20 2.79 0.04 -1.26 -0.59 135.00 139.82 1ce8 s PRO 360 Ca -0.13 1.46 -0.03 0.00 0.04 0.00 0.00 61.00 62.34 1ce8 s PRO 360 Cb -0.16 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.34 1ce8 s PRO 360 CO 0.03 -0.78 -0.06 0.50 0.04 0.00 0.00 177.00 176.72 1ce8 s ARG 361 N -3.49 3.40 0.40 4.56 6.06 0.56 -4.86 118.95 125.59 1ce8 s ARG 361 Ca 0.69 -0.63 0.08 0.00 -2.50 0.00 0.00 55.73 53.37 1ce8 s ARG 361 Cb -0.20 -2.91 -0.02 0.00 0.06 0.00 0.00 34.95 31.87 1ce8 s ARG 361 CO 0.28 -0.08 0.37 -0.06 -2.50 0.00 0.00 175.30 173.32 1ce8 s PHE 362 N 1.14 2.75 -0.29 5.12 0.08 -1.26 0.19 117.98 125.70 1ce8 s PHE 362 Ca 0.02 -0.46 0.19 0.00 0.12 0.00 0.00 56.93 56.81 1ce8 s PHE 362 Cb -0.14 -2.12 0.48 0.00 -0.57 0.00 0.00 43.02 40.66 1ce8 s PHE 362 CO -0.01 -0.08 1.15 0.09 -0.10 0.00 0.00 175.22 176.26 1ce8 n ASN 363 N -1.53 0.90 0.25 1.36 5.03 -1.26 -4.83 115.26 115.18 1ce8 n ASN 363 Ca 0.03 -2.25 0.08 0.00 0.87 0.00 0.00 54.58 53.31 1ce8 n ASN 363 Cb 0.61 -0.24 0.64 0.00 -1.02 0.00 0.00 39.78 39.78 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 2.45 0.00 0.00 3.10 0.04 -1.92 -1.82 116.94 118.79 1ce8 h PHE 364 Ca -0.18 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.59 1ce8 h PHE 364 Cb 1.25 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.40 1ce8 h PHE 364 CO 0.40 0.00 -0.01 1.05 -0.60 0.00 0.00 178.31 179.15 1ce8 h GLU 365 N 0.00 0.00 0.00 1.51 9.09 -1.97 0.18 114.58 123.40 1ce8 h GLU 365 Ca 0.01 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.42 1ce8 h GLU 365 Cb 0.03 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.13 1ce8 h GLU 365 CO -0.00 0.01 -0.48 1.63 0.05 0.00 0.00 179.01 180.22 1ce8 n LYS 366 N -3.37 0.01 -3.20 1.06 5.02 -0.68 -4.34 118.16 112.66 1ce8 n LYS 366 Ca -0.03 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.01 1ce8 n LYS 366 Cb 0.10 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.55 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 -1.51 3.10 -0.08 2.13 3.72 0.64 -5.00 117.46 120.45 1ce8 n PHE 367 Ca 0.06 -4.01 -0.02 0.00 -0.05 0.00 0.00 57.45 53.43 1ce8 n PHE 367 Cb 0.34 -0.50 -0.02 0.00 -0.94 0.00 0.00 39.48 38.36 1ce8 n PHE 367 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ce8 n ALA 368 N 0.44 -0.12 1.38 4.37 0.00 -1.23 -1.07 120.51 124.27 1ce8 n ALA 368 Ca 0.29 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1ce8 n ALA 368 Cb 0.44 0.22 0.00 0.00 0.00 0.00 0.00 19.45 20.11 1ce8 n ALA 368 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ce8 n GLY 369 N -1.05 0.42 3.83 0.00 0.00 -1.26 -4.89 105.19 102.23 1ce8 n GLY 369 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.43 3.49 0.09 4.61 0.00 -0.24 -4.50 121.76 123.78 1ce8 s ALA 370 Ca 0.00 0.03 -0.31 0.00 0.00 0.00 0.00 51.96 51.68 1ce8 s ALA 370 Cb 0.00 -2.69 -0.08 0.00 0.00 0.00 0.00 23.12 20.36 1ce8 s ALA 370 CO 0.00 0.38 1.45 1.21 0.00 0.00 0.00 175.76 178.80 1ce8 s ASN 371 N -1.69 6.78 -0.07 0.00 3.84 -1.26 -4.88 114.94 117.65 1ce8 s ASN 371 Ca 0.41 2.33 0.16 0.00 0.21 0.00 0.00 52.86 55.97 1ce8 s ASN 371 Cb -0.16 -2.58 0.54 0.00 -0.55 0.00 0.00 41.25 38.50 1ce8 s ASN 371 CO 0.20 -0.72 1.46 -0.90 -2.79 0.00 0.00 177.10 174.35 1ce8 n ASP 372 N 4.50 3.90 -4.81 -4.21 5.68 -1.26 -4.96 116.55 115.40 1ce8 n ASP 372 Ca 0.13 -2.35 -0.37 0.00 -0.50 0.00 0.00 54.79 51.69 1ce8 n ASP 372 Cb 0.42 -0.45 -0.06 0.00 -1.14 0.00 0.00 41.12 39.89 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 -1.65 4.31 0.23 0.11 1.81 -1.26 -4.16 118.95 118.34 1ce8 s ARG 373 Ca 0.40 0.90 -0.30 0.00 -1.72 0.00 0.00 55.73 55.01 1ce8 s ARG 373 Cb 0.25 -3.03 -0.09 0.00 -0.45 0.00 0.00 34.95 31.63 1ce8 s ARG 373 CO 0.20 0.48 1.01 -0.51 -0.68 0.00 0.00 175.30 175.80 1ce8 s LEU 374 N -1.64 4.58 0.00 2.53 1.43 0.19 -4.95 118.68 120.83 1ce8 s LEU 374 Ca 0.39 2.06 0.00 0.00 -1.03 0.00 0.00 54.13 55.54 1ce8 s LEU 374 Cb -0.19 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.42 1ce8 s LEU 374 CO 0.22 -0.01 0.00 1.07 0.23 0.00 0.00 176.35 177.86 1ce8 n THR 375 N 1.63 0.00 0.81 5.49 5.66 -1.26 -4.82 114.28 121.78 1ce8 n THR 375 Ca -0.01 0.00 0.13 0.00 -3.05 0.00 0.00 64.05 61.13 1ce8 n THR 375 Cb 0.46 0.00 0.49 0.00 -1.55 0.00 0.00 70.33 69.73 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 0.29 -3.43 1.09 -2.24 -1.18 -1.01 114.28 107.81 1ce8 n THR 376 Ca 0.00 -0.15 -0.40 0.00 -2.27 0.00 0.00 64.05 61.24 1ce8 n THR 376 Cb 0.00 -0.50 -0.10 0.00 -2.10 0.00 0.00 70.33 67.64 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 -3.05 3.78 0.53 -0.78 0.74 -1.26 -3.93 119.66 115.69 1ce8 s GLN 377 Ca 0.12 -0.25 -0.22 0.00 0.05 0.00 0.00 55.36 55.06 1ce8 s GLN 377 Cb 0.16 -3.73 -0.06 0.00 1.10 0.00 0.00 33.01 30.48 1ce8 s GLN 377 CO 0.57 -0.38 1.34 -1.33 -0.55 0.00 0.00 175.29 174.95 1ce8 n MET 378 N 5.31 1.73 0.00 1.67 2.81 -0.43 -4.91 117.12 123.29 1ce8 n MET 378 Ca -0.10 0.63 0.00 0.00 -1.81 0.00 0.00 57.70 56.43 1ce8 n MET 378 Cb 0.50 -2.55 0.00 0.00 -0.71 0.00 0.00 33.22 30.46 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 -0.87 1.92 -2.47 0.03 5.02 -1.26 -4.91 118.16 115.63 1ce8 n LYS 379 Ca 0.10 -0.10 -0.33 0.00 -2.02 0.00 0.00 58.31 55.96 1ce8 n LYS 379 Cb 0.44 -0.45 -0.03 0.00 -0.02 0.00 0.00 35.03 34.97 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 -0.30 6.42 -0.01 4.39 1.04 -1.26 -4.60 113.70 119.38 1ce8 s SER 380 Ca 0.00 1.77 0.18 0.00 0.48 0.00 0.00 55.95 58.38 1ce8 s SER 380 Cb 0.00 -2.54 -0.24 0.00 0.10 0.00 0.00 66.02 63.34 1ce8 s SER 380 CO 0.00 -0.72 0.62 1.33 0.98 0.00 0.00 173.24 175.44 1ce8 n VAL 381 N -1.26 0.00 -2.70 5.02 0.24 0.13 -4.34 118.33 115.42 1ce8 n VAL 381 Ca 0.08 -0.23 0.00 0.00 -2.04 0.00 0.00 64.34 62.15 1ce8 n VAL 381 Cb 0.53 0.60 0.00 0.00 -1.47 0.00 0.00 33.84 33.50 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 1.43 2.07 3.54 7.63 0.00 -0.95 -4.54 105.19 114.37 1ce8 n GLY 382 Ca 0.00 -0.83 -0.12 0.00 0.00 0.00 0.00 46.02 45.08 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 -0.38 0.78 0.19 1.61 -1.05 -1.26 -0.32 118.70 118.27 1ce8 s GLU 383 Ca 0.00 0.02 0.10 0.00 -0.15 0.00 0.00 54.97 54.94 1ce8 s GLU 383 Cb 0.00 0.37 -0.04 0.00 -0.44 0.00 0.00 34.13 34.01 1ce8 s GLU 383 CO 0.00 -0.28 -0.22 0.54 0.95 0.00 0.00 175.26 176.25 1ce8 s VAL 384 N -1.80 2.17 0.10 1.83 0.11 0.24 -4.24 120.40 118.81 1ce8 s VAL 384 Ca -0.02 -2.01 0.05 0.00 -2.93 0.00 0.00 61.98 57.07 1ce8 s VAL 384 Cb -0.01 -2.03 -0.04 0.00 -1.53 0.00 0.00 36.38 32.78 1ce8 s VAL 384 CO -0.00 -0.20 -0.12 -0.32 -3.33 0.00 0.00 175.10 171.12 1ce8 s MET 385 N -2.76 0.91 0.04 1.54 0.00 -0.61 -1.42 119.30 116.99 1ce8 s MET 385 Ca 0.19 -1.17 -0.00 0.00 0.00 0.00 0.00 55.69 54.72 1ce8 s MET 385 Cb -0.07 -0.71 -0.03 0.00 0.00 0.00 0.00 34.83 34.02 1ce8 s MET 385 CO 0.09 0.13 -0.04 0.00 0.00 0.00 0.00 175.02 175.20 1ce8 s ALA 386 N -2.19 0.34 -0.09 4.11 0.00 0.33 -4.83 121.76 119.43 1ce8 s ALA 386 Ca 0.06 -0.85 0.04 0.00 0.00 0.00 0.00 51.96 51.21 1ce8 s ALA 386 Cb -0.04 0.18 0.00 0.00 0.00 0.00 0.00 23.12 23.26 1ce8 s ALA 386 CO 0.02 -0.22 -0.22 0.42 0.00 0.00 0.00 175.76 175.76 1ce8 s ILE 387 N -2.37 1.86 0.05 0.00 1.01 -1.26 -0.83 121.20 119.66 1ce8 s ILE 387 Ca -0.06 -0.91 -0.05 0.00 0.00 0.00 0.00 60.65 59.62 1ce8 s ILE 387 Cb -0.03 -1.62 -0.01 0.00 0.01 0.00 0.00 42.46 40.81 1ce8 s ILE 387 CO -0.04 0.52 0.09 -0.83 0.00 0.00 0.00 174.94 174.68 1ce8 s GLY 388 N 0.32 0.21 0.12 6.18 0.00 -0.77 -4.71 107.32 108.66 1ce8 s GLY 388 Ca -0.16 -0.66 0.21 0.00 0.00 0.00 0.00 44.72 44.11 1ce8 s GLY 388 CO 0.07 -0.80 1.65 0.54 0.00 0.00 0.00 173.10 174.56 1ce8 n ARG 389 N 0.56 0.10 -3.91 2.90 5.12 -1.26 -0.11 116.66 120.06 1ce8 n ARG 389 Ca -0.18 0.28 -0.09 0.00 -1.93 0.00 0.00 57.85 55.93 1ce8 n ARG 389 Cb 0.59 -1.67 -0.09 0.00 -1.16 0.00 0.00 32.46 30.14 1ce8 n ARG 389 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 1ce8 s THR 390 N -3.13 0.13 0.20 0.55 -4.23 -1.26 -4.56 115.64 103.35 1ce8 s THR 390 Ca 0.07 -1.11 -0.15 0.00 -1.18 0.00 0.00 61.69 59.33 1ce8 s THR 390 Cb 0.11 -1.00 0.19 0.00 1.34 0.00 0.00 72.50 73.15 1ce8 s THR 390 CO 0.38 -0.61 1.64 -0.61 -0.54 0.00 0.00 174.62 174.88 1ce8 h GLN 391 N 3.46 0.00 0.14 3.99 5.75 -1.91 0.47 115.11 127.02 1ce8 h GLN 391 Ca -0.33 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.18 1ce8 h GLN 391 Cb 1.19 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.72 1ce8 h GLN 391 CO 0.52 0.00 -0.14 1.96 -2.65 0.00 0.00 178.83 178.52 1ce8 h GLN 392 N 0.00 -0.30 -0.84 1.69 4.20 -1.95 0.77 115.11 118.68 1ce8 h GLN 392 Ca 0.27 0.02 0.03 0.00 0.06 0.00 0.00 58.65 59.03 1ce8 h GLN 392 Cb 0.41 0.07 -0.05 0.00 0.30 0.00 0.00 27.48 28.21 1ce8 h GLN 392 CO -0.58 -0.20 0.54 1.49 -0.67 0.00 0.00 178.83 179.42 1ce8 h GLU 393 N -0.31 1.03 0.22 1.46 4.81 -1.52 0.04 114.58 120.31 1ce8 h GLU 393 Ca 0.00 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1ce8 h GLU 393 Cb 0.29 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1ce8 h GLU 393 CO -0.04 0.68 -0.10 1.03 -0.73 0.00 0.00 179.01 179.85 1ce8 h SER 394 N 1.06 -0.25 -0.44 1.04 0.87 -0.55 -0.82 113.55 114.47 1ce8 h SER 394 Ca 0.33 -0.10 0.02 0.00 -1.23 0.00 0.00 61.79 60.81 1ce8 h SER 394 Cb -0.00 0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 61.99 1ce8 h SER 394 CO -0.11 -0.05 0.26 0.25 -0.53 0.00 0.00 176.83 176.65 1ce8 h LEU 395 N -0.44 0.42 -0.83 2.23 5.85 -0.75 -1.29 115.31 120.50 1ce8 h LEU 395 Ca -0.03 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.61 1ce8 h LEU 395 Cb 0.34 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1ce8 h LEU 395 CO 0.05 0.30 0.01 1.56 -0.34 0.00 0.00 178.44 180.02 1ce8 h GLN 396 N 0.53 0.88 -0.65 1.25 4.20 -0.96 -0.59 115.11 119.77 1ce8 h GLN 396 Ca 0.17 -0.25 -0.06 0.00 0.06 0.00 0.00 58.65 58.57 1ce8 h GLN 396 Cb 0.00 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.66 1ce8 h GLN 396 CO -0.08 0.87 0.17 0.87 -0.67 0.00 0.00 178.83 180.00 1ce8 h LYS 397 N 0.82 1.03 -0.29 1.46 1.57 -0.78 -2.46 116.57 117.91 1ce8 h LYS 397 Ca 0.16 -0.24 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1ce8 h LYS 397 Cb 0.48 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1ce8 h LYS 397 CO 0.02 0.92 0.18 0.00 -0.57 0.00 0.00 179.45 180.00 1ce8 h ALA 398 N 1.06 0.37 -0.72 3.86 0.00 -0.83 -2.54 119.26 120.46 1ce8 h ALA 398 Ca 0.21 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.10 1ce8 h ALA 398 Cb 0.35 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1ce8 h ALA 398 CO 0.00 -0.14 0.45 -0.07 0.00 0.00 0.00 179.25 179.50 1ce8 h LEU 399 N 0.37 0.74 0.00 0.00 3.38 -0.91 -2.20 115.31 116.69 1ce8 h LEU 399 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1ce8 h LEU 399 Cb 0.00 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.60 1ce8 h LEU 399 CO -0.02 0.51 0.00 -2.11 0.09 0.00 0.00 178.44 176.91 1ce8 n ARG 400 N -4.66 0.11 -0.01 1.13 1.85 -0.95 -2.94 116.66 111.19 1ce8 n ARG 400 Ca 0.08 0.12 0.06 0.00 -1.00 0.00 0.00 57.85 57.10 1ce8 n ARG 400 Cb 0.09 -1.50 0.05 0.00 -1.05 0.00 0.00 32.46 30.06 1ce8 n ARG 400 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1ce8 n GLY 401 N 0.65 -0.11 0.10 2.89 0.00 -0.87 -4.51 105.19 103.33 1ce8 n GLY 401 Ca 0.07 -0.34 0.10 0.00 0.00 0.00 0.00 46.02 45.85 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 0.65 0.45 -2.48 0.99 7.94 -0.95 -4.39 117.00 119.22 1ce8 n LEU 402 Ca 0.07 0.63 -0.20 0.00 -1.11 0.00 0.00 56.01 55.40 1ce8 n LEU 402 Cb 0.30 -0.59 0.01 0.00 0.53 0.00 0.00 43.42 43.67 1ce8 n LEU 402 CO 0.07 -0.54 -0.11 -0.62 -1.11 0.00 0.00 177.39 175.08 1ce8 n GLU 403 N -2.02 -3.11 -0.21 1.96 -0.58 -1.26 -4.74 120.64 110.68 1ce8 n GLU 403 Ca 0.02 0.87 0.06 0.00 -0.42 0.00 0.00 57.16 57.68 1ce8 n GLU 403 Cb 0.17 -5.49 0.16 0.00 -0.57 0.00 0.00 31.44 25.70 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 -4.23 1.27 -0.66 2.62 0.24 -1.26 -4.94 118.33 111.37 1ce8 n VAL 404 Ca -0.16 -1.20 0.00 0.00 -2.04 0.00 0.00 64.34 60.94 1ce8 n VAL 404 Cb 0.64 0.34 0.00 0.00 -1.47 0.00 0.00 33.84 33.34 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 0.15 0.78 3.85 7.63 0.00 -1.26 -5.05 105.19 111.29 1ce8 n GLY 405 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.93 3.22 -0.64 4.61 0.00 -1.26 -4.96 121.76 119.80 1ce8 s ALA 406 Ca 0.00 0.06 0.05 0.00 0.00 0.00 0.00 51.96 52.08 1ce8 s ALA 406 Cb 0.00 -2.90 0.06 0.00 0.00 0.00 0.00 23.12 20.28 1ce8 s ALA 406 CO 0.00 0.05 0.76 0.25 0.00 0.00 0.00 175.76 176.83 1ce8 n THR 407 N -1.00 0.20 0.00 0.00 -2.24 -1.26 -4.36 114.28 105.62 1ce8 n THR 407 Ca 0.05 -0.60 0.00 0.00 -2.27 0.00 0.00 64.05 61.23 1ce8 n THR 407 Cb 0.54 0.99 0.00 0.00 -2.10 0.00 0.00 70.33 69.76 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 0.25 0.11 2.89 3.38 0.00 -1.26 -4.15 105.19 106.40 1ce8 n GLY 408 Ca 0.04 -0.63 -0.43 0.00 0.00 0.00 0.00 46.02 45.00 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 3.06 -2.32 1.61 3.01 -1.26 -4.85 117.46 116.71 1ce8 n PHE 409 Ca 0.00 -2.82 -0.38 0.00 1.01 0.00 0.00 57.45 55.26 1ce8 n PHE 409 Cb 0.00 -1.98 -0.02 0.00 -0.01 0.00 0.00 39.48 37.47 1ce8 n PHE 409 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1ce8 s ASP 410 N 1.03 6.61 0.38 4.37 1.01 -1.26 -4.97 116.67 123.83 1ce8 s ASP 410 Ca 0.40 2.34 -0.27 0.00 0.71 0.00 0.00 52.55 55.73 1ce8 s ASP 410 Cb 0.09 -2.61 -0.09 0.00 1.01 0.00 0.00 42.92 41.32 1ce8 s ASP 410 CO 0.00 -0.61 1.22 -2.84 0.21 0.00 0.00 175.17 173.15 1ce8 s PRO 411 N -2.22 4.15 -0.24 8.23 0.02 -1.26 -4.91 135.00 138.77 1ce8 s PRO 411 Ca 0.56 2.00 0.07 0.00 0.02 0.00 0.00 61.00 63.64 1ce8 s PRO 411 Cb -0.31 -2.83 -0.19 0.00 0.02 0.00 0.00 34.50 31.19 1ce8 s PRO 411 CO 0.39 -0.28 -0.14 1.17 -0.33 0.00 0.00 177.00 177.81 1ce8 n LYS 412 N 0.35 0.67 -4.35 5.54 3.00 -1.26 -5.00 118.16 117.11 1ce8 n LYS 412 Ca 0.03 0.10 -0.27 0.00 -0.00 0.00 0.00 58.31 58.17 1ce8 n LYS 412 Cb 0.45 -1.51 -0.11 0.00 0.00 0.00 0.00 35.03 33.85 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 -2.51 2.77 0.31 3.15 -7.23 -1.26 -5.11 120.40 110.52 1ce8 s VAL 413 Ca -0.27 -1.80 -0.27 0.00 -1.81 0.00 0.00 61.98 57.83 1ce8 s VAL 413 Cb 0.08 -2.34 -0.10 0.00 0.56 0.00 0.00 36.38 34.58 1ce8 s VAL 413 CO 0.66 -0.08 0.96 -0.55 -0.31 0.00 0.00 175.10 175.78 1ce8 s SER 414 N -2.66 7.33 0.38 4.85 0.15 -1.26 -4.93 113.70 117.56 1ce8 s SER 414 Ca 0.22 1.90 0.10 0.00 0.70 0.00 0.00 55.95 58.87 1ce8 s SER 414 Cb -0.09 -2.59 0.77 0.00 -1.71 0.00 0.00 66.02 62.41 1ce8 s SER 414 CO 0.12 -0.08 1.90 -0.07 1.20 0.00 0.00 173.24 176.31 1ce8 h LEU 415 N 3.31 0.18 -0.33 3.45 3.38 -1.99 -1.87 115.31 121.44 1ce8 h LEU 415 Ca -0.47 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.46 1ce8 h LEU 415 Cb 1.20 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1ce8 h LEU 415 CO 0.65 0.38 -0.09 -0.90 0.09 0.00 0.00 178.44 178.58 1ce8 n ASP 416 N -4.24 0.60 -4.66 -0.43 5.75 -1.26 -4.82 116.55 107.49 1ce8 n ASP 416 Ca -0.01 -0.79 -0.42 0.00 -0.01 0.00 0.00 54.79 53.55 1ce8 n ASP 416 Cb 0.30 -0.04 -0.03 0.00 -1.03 0.00 0.00 41.12 40.32 1ce8 n ASP 416 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1ce8 s ASP 417 N -2.34 6.78 0.29 -1.12 -1.08 -0.70 -4.88 116.67 113.61 1ce8 s ASP 417 Ca 0.32 2.06 0.25 0.00 -0.52 0.00 0.00 52.55 54.67 1ce8 s ASP 417 Cb 0.20 -2.54 0.72 0.00 -1.46 0.00 0.00 42.92 39.85 1ce8 s ASP 417 CO 0.44 -0.85 1.74 1.55 0.52 0.00 0.00 175.17 178.57 1ce8 h PRO 418 N 8.86 0.00 0.00 4.34 0.14 -1.87 -3.15 132.00 140.32 1ce8 h PRO 418 Ca -0.35 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.79 1ce8 h PRO 418 Cb 1.16 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.30 1ce8 h PRO 418 CO 0.95 0.00 -1.21 0.39 0.14 0.00 0.00 178.00 178.27 1ce8 n GLU 419 N -2.52 0.19 -0.33 0.86 1.02 -1.26 -4.56 120.64 114.04 1ce8 n GLU 419 Ca 0.05 -0.05 0.17 0.00 -0.02 0.00 0.00 57.16 57.31 1ce8 n GLU 419 Cb 0.44 -1.52 0.34 0.00 -0.02 0.00 0.00 31.44 30.68 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 2.71 1.34 0.00 0.62 0.00 -1.86 1.28 119.26 123.35 1ce8 h ALA 420 Ca 0.00 0.31 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 1ce8 h ALA 420 Cb 0.64 0.52 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1ce8 h ALA 420 CO 0.00 -0.62 -0.07 -0.07 0.00 0.00 0.00 179.25 178.49 1ce8 h LEU 421 N 0.03 0.00 -0.03 0.00 3.38 -1.81 0.47 115.31 117.35 1ce8 h LEU 421 Ca 0.63 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.56 1ce8 h LEU 421 Cb 1.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 1ce8 h LEU 421 CO -0.86 0.07 -0.14 0.74 0.09 0.00 0.00 178.44 178.33 1ce8 h THR 422 N 0.00 1.48 -0.52 0.22 2.02 0.13 -2.19 112.91 114.04 1ce8 h THR 422 Ca -0.00 -1.61 -0.10 0.00 0.77 0.00 0.00 66.41 65.47 1ce8 h THR 422 Cb 0.17 2.45 -0.02 0.00 -1.74 0.00 0.00 68.15 69.01 1ce8 h THR 422 CO 0.01 0.44 -0.06 0.07 0.37 0.00 0.00 175.52 176.35 1ce8 h LYS 423 N -0.42 0.93 -0.17 6.66 2.10 -1.13 -2.43 116.57 122.11 1ce8 h LYS 423 Ca -0.01 -0.31 -0.00 0.00 -2.00 0.00 0.00 60.65 58.33 1ce8 h LYS 423 Cb 0.79 -0.08 -0.01 0.00 -0.90 0.00 0.00 32.23 32.04 1ce8 h LYS 423 CO 0.03 0.96 0.10 0.82 -2.00 0.00 0.00 179.45 179.36 1ce8 h ILE 424 N 0.85 1.09 -0.76 0.07 2.04 -0.99 -1.36 117.51 118.45 1ce8 h ILE 424 Ca 0.14 -0.24 0.06 0.00 1.00 0.00 0.00 64.86 65.82 1ce8 h ILE 424 Cb 0.59 0.95 -0.06 0.00 -0.74 0.00 0.00 36.82 37.56 1ce8 h ILE 424 CO 0.04 0.09 0.45 -0.09 0.00 0.00 0.00 178.15 178.63 1ce8 h ARG 425 N 0.18 0.80 -0.07 2.37 2.43 -1.25 -2.20 114.38 116.65 1ce8 h ARG 425 Ca 0.06 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1ce8 h ARG 425 Cb 0.05 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.42 1ce8 h ARG 425 CO -0.01 0.53 0.04 -0.09 -1.51 0.00 0.00 179.97 178.93 1ce8 h ARG 426 N 0.83 0.09 0.00 0.20 1.12 -1.19 -1.16 114.38 114.28 1ce8 h ARG 426 Ca 0.34 -0.01 -0.02 0.00 -1.11 0.00 0.00 59.98 59.17 1ce8 h ARG 426 Cb 0.18 -0.02 -0.00 0.00 -0.01 0.00 0.00 29.97 30.11 1ce8 h ARG 426 CO -0.18 0.09 -0.11 0.93 -3.11 0.00 0.00 179.97 177.60 1ce8 h GLU 427 N 0.06 0.00 0.02 0.20 4.39 -0.94 0.88 114.58 119.19 1ce8 h GLU 427 Ca 0.02 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.55 1ce8 h GLU 427 Cb 0.02 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 1ce8 h GLU 427 CO -0.00 0.11 -0.92 -0.07 -1.16 0.00 0.00 179.01 176.97 1ce8 h LEU 428 N 0.00 0.07 -0.83 1.33 4.07 -1.31 -3.31 115.31 115.34 1ce8 h LEU 428 Ca -0.00 -0.72 -0.09 0.00 0.08 0.00 0.00 57.88 57.15 1ce8 h LEU 428 Cb 0.25 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 41.95 1ce8 h LEU 428 CO 0.01 1.37 -0.11 0.50 -1.08 0.00 0.00 178.44 179.14 1ce8 h LYS 429 N -0.86 0.76 -2.94 1.13 3.64 -1.08 -3.38 116.57 113.84 1ce8 h LYS 429 Ca -0.24 -0.25 -0.61 0.00 -1.27 0.00 0.00 60.65 58.28 1ce8 h LYS 429 Cb 1.31 -0.06 -0.40 0.00 -0.41 0.00 0.00 32.23 32.66 1ce8 h LYS 429 CO -0.10 0.84 -0.74 -0.51 -2.27 0.00 0.00 179.45 176.67 1ce8 s ASP 430 N -6.70 3.55 0.28 4.20 1.01 0.29 -4.91 116.67 114.40 1ce8 s ASP 430 Ca -0.09 -2.79 -0.30 0.00 0.71 0.00 0.00 52.55 50.08 1ce8 s ASP 430 Cb 0.14 -1.04 -0.13 0.00 1.01 0.00 0.00 42.92 42.90 1ce8 s ASP 430 CO 0.82 -0.24 1.30 0.00 0.21 0.00 0.00 175.17 177.27 1ce8 n ALA 431 N 3.31 0.92 -4.31 5.23 0.00 -1.25 -4.51 120.51 119.90 1ce8 n ALA 431 Ca 0.12 0.39 -0.19 0.00 0.00 0.00 0.00 53.44 53.77 1ce8 n ALA 431 Cb 0.36 -2.22 -0.04 0.00 0.00 0.00 0.00 19.45 17.54 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 1.55 3.72 0.16 0.00 0.00 -1.26 0.55 105.19 109.91 1ce8 n GLY 432 Ca 0.09 -2.20 0.13 0.00 0.00 0.00 0.00 46.02 44.04 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 1.26 1.00 -0.07 4.61 0.00 -1.96 -3.02 119.26 121.07 1ce8 h ALA 433 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1ce8 h ALA 433 Cb 0.77 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1ce8 h ALA 433 CO 0.38 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.38 1ce8 n ASP 434 N -2.38 2.71 -0.35 0.00 8.00 -1.26 -4.58 116.55 118.70 1ce8 n ASP 434 Ca 0.01 -1.89 0.13 0.00 0.71 0.00 0.00 54.79 53.74 1ce8 n ASP 434 Cb 0.19 -0.03 0.26 0.00 -0.02 0.00 0.00 41.12 41.52 1ce8 n ASP 434 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1ce8 n ARG 435 N 1.10 -0.08 -0.32 -1.24 0.63 -1.14 -0.92 116.66 114.69 1ce8 n ARG 435 Ca 0.16 1.50 0.13 0.00 -0.92 0.00 0.00 57.85 58.72 1ce8 n ARG 435 Cb 0.54 -2.35 0.36 0.00 0.45 0.00 0.00 32.46 31.46 1ce8 n ARG 435 CO 0.00 0.00 0.00 0.97 -2.51 0.00 0.00 177.63 176.09 1ce8 h ILE 436 N 0.00 0.77 0.03 5.15 6.09 -1.87 0.12 117.51 127.79 1ce8 h ILE 436 Ca 0.57 -0.25 -0.22 0.00 -1.37 0.00 0.00 64.86 63.59 1ce8 h ILE 436 Cb 1.12 -0.02 -0.00 0.00 0.47 0.00 0.00 36.82 38.39 1ce8 h ILE 436 CO -0.95 0.13 -0.98 -0.50 -3.07 0.00 0.00 178.15 172.78 1ce8 h TRP 437 N 0.72 0.41 0.00 2.19 6.55 -1.38 -3.19 115.95 121.25 1ce8 h TRP 437 Ca 0.52 -0.25 -0.01 0.00 0.95 0.00 0.00 58.89 60.10 1ce8 h TRP 437 Cb 0.85 -0.04 -0.00 0.00 -0.86 0.00 0.00 29.16 29.11 1ce8 h TRP 437 CO -0.00 1.09 -0.06 1.88 -1.05 0.00 0.00 178.44 180.30 1ce8 h TYR 438 N 0.13 0.00 -0.14 0.49 0.05 -0.78 -2.46 116.97 114.27 1ce8 h TYR 438 Ca -0.07 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.70 1ce8 h TYR 438 Cb 1.64 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.37 1ce8 h TYR 438 CO 0.04 0.06 0.04 0.82 -1.05 0.00 0.00 178.16 178.08 1ce8 h ILE 439 N 0.00 1.19 -0.38 -2.88 2.04 -1.18 0.18 117.51 116.48 1ce8 h ILE 439 Ca -0.00 -0.58 -0.02 0.00 1.00 0.00 0.00 64.86 65.26 1ce8 h ILE 439 Cb 0.63 1.31 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 1ce8 h ILE 439 CO 0.01 0.17 0.15 0.00 0.00 0.00 0.00 178.15 178.48 1ce8 h ALA 440 N 0.85 0.49 -0.62 1.87 0.00 -1.58 -1.78 119.26 118.48 1ce8 h ALA 440 Ca 0.04 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.83 1ce8 h ALA 440 Cb 0.23 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1ce8 h ALA 440 CO -0.00 0.10 0.41 -0.44 0.00 0.00 0.00 179.25 179.32 1ce8 h ASP 441 N 0.46 0.67 -0.55 0.00 3.32 -1.30 0.60 116.42 119.63 1ce8 h ASP 441 Ca 0.12 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.10 1ce8 h ASP 441 Cb 0.19 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 1ce8 h ASP 441 CO -0.01 0.48 0.14 0.00 -1.72 0.00 0.00 179.24 178.13 1ce8 h ALA 442 N 1.62 1.13 -0.19 3.45 0.00 0.21 0.18 119.26 125.66 1ce8 h ALA 442 Ca 0.24 -0.22 -0.18 0.00 0.00 0.00 0.00 54.91 54.75 1ce8 h ALA 442 Cb -0.01 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 1ce8 h ALA 442 CO -0.06 0.59 -0.62 0.74 0.00 0.00 0.00 179.25 179.90 1ce8 h PHE 443 N 0.89 0.84 -0.28 0.00 0.04 -0.68 -0.68 116.94 117.07 1ce8 h PHE 443 Ca 0.19 -0.32 -0.04 0.00 2.80 0.00 0.00 57.97 60.60 1ce8 h PHE 443 Cb 0.33 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 38.31 1ce8 h PHE 443 CO 0.02 1.10 0.02 0.00 -0.60 0.00 0.00 178.31 178.85 1ce8 h ARG 444 N 0.49 0.42 0.00 1.51 3.08 -0.40 -2.49 114.38 116.97 1ce8 h ARG 444 Ca -0.01 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1ce8 h ARG 444 Cb 1.20 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.18 1ce8 h ARG 444 CO 0.12 0.43 0.00 0.00 -1.07 0.00 0.00 179.97 179.45 1ce8 n ALA 445 N -2.48 2.63 -0.03 0.04 0.00 0.59 -4.89 120.51 116.35 1ce8 n ALA 445 Ca 0.01 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1ce8 n ALA 445 Cb 0.21 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.21 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 0.88 0.60 3.81 0.00 0.00 -0.94 -5.05 105.19 104.49 1ce8 n GLY 446 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 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 0.40 0.99 1.43 -0.29 -5.02 118.68 120.11 1ce8 s LEU 447 Ca 0.00 1.76 -0.00 0.00 -1.03 0.00 0.00 54.13 54.86 1ce8 s LEU 447 Cb 0.00 -4.52 -0.02 0.00 0.03 0.00 0.00 46.19 41.67 1ce8 s LEU 447 CO 0.00 -0.45 0.61 -0.94 0.23 0.00 0.00 176.35 175.80 1ce8 s SER 448 N -2.10 6.13 0.19 2.29 1.04 -1.26 -4.48 113.70 115.50 1ce8 s SER 448 Ca 0.63 0.44 -0.12 0.00 0.48 0.00 0.00 55.95 57.38 1ce8 s SER 448 Cb -0.11 -1.88 0.21 0.00 0.10 0.00 0.00 66.02 64.34 1ce8 s SER 448 CO 0.15 -0.47 1.74 0.58 0.98 0.00 0.00 173.24 176.23 1ce8 h VAL 449 N 0.58 0.80 -0.28 5.02 2.07 -1.96 0.44 116.25 122.92 1ce8 h VAL 449 Ca -0.48 -0.12 -0.06 0.00 0.82 0.00 0.00 66.70 66.85 1ce8 h VAL 449 Cb 1.23 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 1ce8 h VAL 449 CO 0.60 0.07 -0.10 0.44 0.02 0.00 0.00 177.57 178.60 1ce8 h ASP 450 N 0.36 0.43 0.20 0.57 3.32 -1.98 0.31 116.42 119.63 1ce8 h ASP 450 Ca 0.26 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 57.21 1ce8 h ASP 450 Cb 0.30 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1ce8 h ASP 450 CO -0.27 0.57 -0.15 1.23 -1.72 0.00 0.00 179.24 178.91 1ce8 h GLY 451 N 0.87 -0.35 1.38 2.75 0.00 -0.69 -1.12 103.07 105.92 1ce8 h GLY 451 Ca 0.08 0.16 -0.06 0.00 0.00 0.00 0.00 47.33 47.51 1ce8 h GLY 451 CO 0.02 -0.15 0.03 -2.08 0.00 0.00 0.00 176.54 174.36 1ce8 h VAL 452 N -0.35 1.23 0.51 4.60 2.07 -0.12 -3.06 116.25 121.13 1ce8 h VAL 452 Ca -0.01 -0.93 -0.02 0.00 0.82 0.00 0.00 66.70 66.56 1ce8 h VAL 452 Cb 0.31 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 1ce8 h VAL 452 CO -0.00 0.33 -0.39 0.15 0.02 0.00 0.00 177.57 177.69 1ce8 h PHE 453 N 0.72 -1.03 -1.16 1.57 3.57 0.01 -1.20 116.94 119.41 1ce8 h PHE 453 Ca 0.15 -0.00 0.35 0.00 3.53 0.00 0.00 57.97 61.99 1ce8 h PHE 453 Cb 0.40 0.39 -0.11 0.00 2.79 0.00 0.00 35.95 39.41 1ce8 h PHE 453 CO 0.02 -0.56 0.74 -0.91 -2.23 0.00 0.00 178.31 175.37 1ce8 h ASN 454 N -0.88 0.36 0.71 0.41 2.35 -1.12 0.65 115.58 118.06 1ce8 h ASN 454 Ca -0.05 0.12 -0.22 0.00 -0.55 0.00 0.00 56.30 55.60 1ce8 h ASN 454 Cb 0.74 0.08 -0.04 0.00 0.05 0.00 0.00 38.32 39.15 1ce8 h ASN 454 CO 0.01 -0.06 -1.41 -0.07 -1.65 0.00 0.00 177.43 174.25 1ce8 h LEU 455 N 0.25 0.00 0.00 1.61 3.38 -1.37 -3.40 115.31 115.77 1ce8 h LEU 455 Ca 0.71 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.67 1ce8 h LEU 455 Cb 2.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.75 1ce8 h LEU 455 CO -0.38 0.78 -1.55 0.35 0.09 0.00 0.00 178.44 177.73 1ce8 n THR 456 N -3.02 0.02 -1.02 0.22 -2.24 -0.09 -3.88 114.28 104.26 1ce8 n THR 456 Ca -0.11 -0.28 -0.01 0.00 -2.27 0.00 0.00 64.05 61.39 1ce8 n THR 456 Cb 0.92 0.20 -0.00 0.00 -2.10 0.00 0.00 70.33 69.35 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 -1.93 -5.06 -4.68 3.42 5.03 0.21 -4.59 115.26 107.66 1ce8 n ASN 457 Ca -0.03 0.02 -0.42 0.00 0.87 0.00 0.00 54.58 55.02 1ce8 n ASN 457 Cb 0.32 -2.64 -0.03 0.00 -1.02 0.00 0.00 39.78 36.42 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 -1.38 4.80 0.12 2.41 1.01 -1.26 -4.49 121.20 122.41 1ce8 s ILE 458 Ca 0.00 1.96 -0.35 0.00 0.00 0.00 0.00 60.65 62.26 1ce8 s ILE 458 Cb 0.00 -4.28 -0.16 0.00 0.01 0.00 0.00 42.46 38.03 1ce8 s ILE 458 CO 0.00 -0.00 1.33 -0.67 0.00 0.00 0.00 174.94 175.59 1ce8 n ASP 459 N 5.14 1.79 0.15 3.58 -0.08 -1.26 -4.71 116.55 121.17 1ce8 n ASP 459 Ca 0.08 1.12 0.19 0.00 -1.51 0.00 0.00 54.79 54.67 1ce8 n ASP 459 Cb 0.49 -1.24 0.79 0.00 2.34 0.00 0.00 41.12 43.49 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 4.40 0.00 -0.89 -0.67 3.08 -1.94 0.73 114.38 119.10 1ce8 h ARG 460 Ca -0.46 0.00 0.13 0.00 0.07 0.00 0.00 59.98 59.72 1ce8 h ARG 460 Cb 1.32 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.29 1ce8 h ARG 460 CO 0.77 0.00 0.51 2.35 -1.07 0.00 0.00 179.97 182.53 1ce8 h TRP 461 N 0.00 0.90 0.17 3.04 7.01 -2.02 -0.62 115.95 124.44 1ce8 h TRP 461 Ca 0.14 0.03 -0.24 0.00 2.11 0.00 0.00 58.89 60.93 1ce8 h TRP 461 Cb 0.81 -0.27 0.02 0.00 -2.10 0.00 0.00 29.16 27.63 1ce8 h TRP 461 CO 0.00 0.29 -1.06 0.74 -2.79 0.00 0.00 178.44 175.62 1ce8 h PHE 462 N 0.76 0.67 -0.23 2.65 0.04 -1.22 -3.37 116.94 116.24 1ce8 h PHE 462 Ca 0.46 -0.49 0.06 0.00 2.80 0.00 0.00 57.97 60.81 1ce8 h PHE 462 Cb 0.56 -0.03 -0.06 0.00 2.20 0.00 0.00 35.95 38.62 1ce8 h PHE 462 CO -0.06 1.40 -0.18 -0.07 -0.60 0.00 0.00 178.31 178.81 1ce8 h LEU 463 N -0.22 -0.59 -1.02 1.54 3.38 -0.76 -2.74 115.31 114.90 1ce8 h LEU 463 Ca -0.19 0.12 0.15 0.00 0.09 0.00 0.00 57.88 58.05 1ce8 h LEU 463 Cb 1.81 0.29 -0.09 0.00 0.09 0.00 0.00 40.66 42.76 1ce8 h LEU 463 CO 0.18 -0.22 0.62 -0.37 0.09 0.00 0.00 178.44 178.74 1ce8 h VAL 464 N -0.18 0.82 -0.36 1.22 -1.51 -1.31 -1.21 116.25 113.71 1ce8 h VAL 464 Ca 0.13 -0.30 -0.10 0.00 -1.23 0.00 0.00 66.70 65.20 1ce8 h VAL 464 Cb 0.38 -0.14 -0.02 0.00 -2.13 0.00 0.00 31.29 29.39 1ce8 h VAL 464 CO -0.34 0.16 -0.20 1.56 -1.23 0.00 0.00 177.57 177.52 1ce8 h GLN 465 N 0.88 0.68 -0.36 5.19 4.20 -1.65 0.66 115.11 124.71 1ce8 h GLN 465 Ca 0.54 -0.25 -0.09 0.00 0.06 0.00 0.00 58.65 58.91 1ce8 h GLN 465 Cb 0.69 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 1ce8 h GLN 465 CO -0.32 0.83 -0.13 0.82 -0.67 0.00 0.00 178.83 179.36 1ce8 h ILE 466 N 0.60 1.28 -0.95 2.54 2.04 -1.08 -1.77 117.51 120.17 1ce8 h ILE 466 Ca 0.09 -1.22 -0.00 0.00 1.00 0.00 0.00 64.86 64.73 1ce8 h ILE 466 Cb 0.67 1.33 -0.05 0.00 -0.74 0.00 0.00 36.82 38.03 1ce8 h ILE 466 CO 0.05 0.40 0.57 -0.08 0.00 0.00 0.00 178.15 179.09 1ce8 h GLU 467 N 0.50 1.29 -0.63 2.37 4.81 -1.05 -1.34 114.58 120.53 1ce8 h GLU 467 Ca 0.09 -0.11 0.03 0.00 -0.13 0.00 0.00 59.36 59.23 1ce8 h GLU 467 Cb 0.65 -0.27 -0.04 0.00 0.63 0.00 0.00 28.75 29.72 1ce8 h GLU 467 CO 0.04 0.90 0.38 1.49 -0.73 0.00 0.00 179.01 181.09 1ce8 h GLU 468 N 1.31 0.73 -0.02 1.92 4.81 -0.60 0.00 114.58 122.73 1ce8 h GLU 468 Ca 0.34 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.46 1ce8 h GLU 468 Cb -0.06 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.14 1ce8 h GLU 468 CO -0.06 0.48 -0.29 -0.07 -0.73 0.00 0.00 179.01 178.34 1ce8 h LEU 469 N 0.75 0.03 -0.53 1.64 3.38 -0.42 -2.28 115.31 117.89 1ce8 h LEU 469 Ca 0.26 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.19 1ce8 h LEU 469 Cb 0.03 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1ce8 h LEU 469 CO -0.11 0.32 0.22 0.58 0.09 0.00 0.00 178.44 179.54 1ce8 h VAL 470 N 0.03 1.22 -0.66 1.22 2.07 0.03 -0.45 116.25 119.70 1ce8 h VAL 470 Ca 0.00 -0.66 -0.03 0.00 0.82 0.00 0.00 66.70 66.83 1ce8 h VAL 470 Cb 0.53 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 1ce8 h VAL 470 CO 0.04 0.25 0.30 0.03 0.02 0.00 0.00 177.57 178.21 1ce8 h ARG 471 N 0.72 0.96 -0.51 1.57 2.47 -0.92 -0.22 114.38 118.43 1ce8 h ARG 471 Ca 0.18 -0.14 -0.08 0.00 -1.26 0.00 0.00 59.98 58.68 1ce8 h ARG 471 Cb 0.19 -0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.31 1ce8 h ARG 471 CO -0.02 0.76 0.01 -0.07 0.56 0.00 0.00 179.97 181.21 1ce8 h LEU 472 N 0.95 0.83 -0.52 3.04 3.38 -0.91 -1.62 115.31 120.45 1ce8 h LEU 472 Ca 0.23 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1ce8 h LEU 472 Cb 0.13 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1ce8 h LEU 472 CO -0.03 0.88 0.20 -0.33 0.09 0.00 0.00 178.44 179.26 1ce8 h GLU 473 N 0.80 0.78 -0.55 1.13 5.08 -0.15 -0.69 114.58 120.98 1ce8 h GLU 473 Ca 0.15 -0.15 0.02 0.00 -1.00 0.00 0.00 59.36 58.39 1ce8 h GLU 473 Cb 0.47 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 1ce8 h GLU 473 CO 0.02 0.70 0.36 0.93 -1.00 0.00 0.00 179.01 180.02 1ce8 h GLU 474 N 0.70 0.66 -0.20 2.33 5.08 -0.54 -1.22 114.58 121.40 1ce8 h GLU 474 Ca 0.17 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.40 1ce8 h GLU 474 Cb 0.21 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 1ce8 h GLU 474 CO -0.01 0.44 -0.23 -0.22 -1.00 0.00 0.00 179.01 177.99 1ce8 h LYS 475 N 0.68 0.51 -0.81 2.33 3.64 -0.71 -2.20 116.57 120.01 1ce8 h LYS 475 Ca 0.21 -0.28 0.05 0.00 -1.27 0.00 0.00 60.65 59.37 1ce8 h LYS 475 Cb 0.01 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 31.79 1ce8 h LYS 475 CO -0.05 0.86 0.50 0.28 -2.27 0.00 0.00 179.45 178.77 1ce8 h VAL 476 N 0.17 1.05 -0.41 2.00 2.07 -0.46 -0.52 116.25 120.16 1ce8 h VAL 476 Ca 0.03 -0.32 -0.04 0.00 0.82 0.00 0.00 66.70 67.19 1ce8 h VAL 476 Cb 0.79 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1ce8 h VAL 476 CO 0.06 0.17 0.08 0.00 0.02 0.00 0.00 177.57 177.90 1ce8 h ALA 477 N 1.38 1.38 0.06 1.67 0.00 -1.20 0.48 119.26 123.03 1ce8 h ALA 477 Ca 0.35 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1ce8 h ALA 477 Cb 0.13 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1ce8 h ALA 477 CO -0.16 0.44 -0.03 1.49 0.00 0.00 0.00 179.25 180.99 1ce8 h GLU 478 N 0.60 -0.08 0.00 0.00 4.81 -0.68 -3.35 114.58 115.87 1ce8 h GLU 478 Ca 0.14 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.33 1ce8 h GLU 478 Cb 0.25 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 1ce8 h GLU 478 CO -0.00 0.51 -0.22 -0.39 -0.73 0.00 0.00 179.01 178.18 1ce8 h VAL 479 N -0.83 0.43 -1.97 0.32 -1.51 -1.11 -3.50 116.25 108.08 1ce8 h VAL 479 Ca -0.01 -1.34 0.14 0.00 -1.23 0.00 0.00 66.70 64.26 1ce8 h VAL 479 Cb 0.63 1.99 -0.03 0.00 -2.13 0.00 0.00 31.29 31.75 1ce8 h VAL 479 CO 0.01 0.21 -0.19 0.61 -1.23 0.00 0.00 177.57 176.99 1ce8 n GLY 480 N 0.71 -1.56 0.36 5.19 0.00 0.15 -2.62 105.19 107.43 1ce8 n GLY 480 Ca 0.02 -1.16 0.09 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.48 0.93 -0.03 -0.61 2.10 -1.84 0.45 117.51 118.04 1ce8 h ILE 481 Ca 0.01 -0.25 0.00 0.00 1.08 0.00 0.00 64.86 65.70 1ce8 h ILE 481 Cb 0.47 0.13 -0.00 0.00 -1.09 0.00 0.00 36.82 36.33 1ce8 h ILE 481 CO 0.00 0.13 0.02 0.74 -1.08 0.00 0.00 178.15 177.97 1ce8 h THR 482 N 0.74 1.00 -0.01 2.19 2.02 -1.97 -0.17 112.91 116.72 1ce8 h THR 482 Ca 0.38 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.55 1ce8 h THR 482 Cb 0.48 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 67.86 1ce8 h THR 482 CO -0.15 0.01 -0.10 0.61 0.37 0.00 0.00 175.52 176.26 1ce8 n GLY 483 N -1.54 -0.53 3.17 2.16 0.00 0.14 -4.56 105.19 104.04 1ce8 n GLY 483 Ca -0.03 -0.36 -0.43 0.00 0.00 0.00 0.00 46.02 45.21 1ce8 n GLY 483 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ce8 n LEU 484 N -0.48 5.89 -4.90 0.99 4.77 -0.08 -4.88 117.00 118.31 1ce8 n LEU 484 Ca 0.16 -4.25 -0.29 0.00 -0.03 0.00 0.00 56.01 51.61 1ce8 n LEU 484 Cb 0.31 -1.64 0.06 0.00 -2.33 0.00 0.00 43.42 39.81 1ce8 n LEU 484 CO 0.21 0.80 0.70 0.54 -1.33 0.00 0.00 177.39 178.31 1ce8 s ASN 485 N 2.93 5.20 0.20 -1.43 2.20 -1.26 -4.74 114.94 118.05 1ce8 s ASN 485 Ca 0.47 0.90 -0.18 0.00 -0.94 0.00 0.00 52.86 53.11 1ce8 s ASN 485 Cb 0.06 -1.66 0.18 0.00 -2.00 0.00 0.00 41.25 37.84 1ce8 s ASN 485 CO 0.00 -1.44 1.58 0.00 -2.94 0.00 0.00 177.10 174.31 1ce8 h ALA 486 N -0.64 0.11 0.13 3.54 0.00 -1.97 0.17 119.26 120.59 1ce8 h ALA 486 Ca -0.45 0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.68 1ce8 h ALA 486 Cb 1.28 0.78 -0.02 0.00 0.00 0.00 0.00 17.79 19.83 1ce8 h ALA 486 CO 0.63 -0.61 -0.18 -0.44 0.00 0.00 0.00 179.25 178.65 1ce8 h ASP 487 N -0.10 -0.49 -0.07 0.00 5.19 -1.98 0.12 116.42 119.08 1ce8 h ASP 487 Ca 0.28 0.05 -0.00 0.00 -0.62 0.00 0.00 57.03 56.74 1ce8 h ASP 487 Cb 0.56 0.18 -0.00 0.00 0.18 0.00 0.00 39.33 40.25 1ce8 h ASP 487 CO -0.76 -0.26 0.03 0.15 -3.12 0.00 0.00 179.24 175.28 1ce8 h PHE 488 N -0.36 0.11 -0.48 4.55 3.57 -1.81 -1.59 116.94 120.92 1ce8 h PHE 488 Ca 0.02 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.57 1ce8 h PHE 488 Cb 0.37 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 39.02 1ce8 h PHE 488 CO -0.17 0.22 0.19 1.25 -2.23 0.00 0.00 178.31 177.57 1ce8 h LEU 489 N -0.03 0.22 -0.74 0.59 5.85 -0.53 -0.45 115.31 120.22 1ce8 h LEU 489 Ca 0.02 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.84 1ce8 h LEU 489 Cb 0.15 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.15 1ce8 h LEU 489 CO -0.00 0.16 0.44 -0.09 -0.34 0.00 0.00 178.44 178.61 1ce8 h ARG 490 N 0.38 0.81 -0.51 1.25 2.43 -0.53 -1.36 114.38 116.84 1ce8 h ARG 490 Ca 0.23 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.33 1ce8 h ARG 490 Cb 0.21 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 1ce8 h ARG 490 CO -0.21 0.53 0.27 0.37 -1.51 0.00 0.00 179.97 179.42 1ce8 h GLN 491 N 0.83 0.71 -0.17 0.20 4.15 -0.28 0.47 115.11 121.02 1ce8 h GLN 491 Ca 0.31 -0.07 -0.16 0.00 0.77 0.00 0.00 58.65 59.50 1ce8 h GLN 491 Cb 0.12 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.67 1ce8 h GLN 491 CO -0.15 0.53 -0.54 -0.07 -1.93 0.00 0.00 178.83 176.67 1ce8 h LEU 492 N 0.71 0.77 -0.15 -2.39 3.38 -0.20 -2.88 115.31 114.54 1ce8 h LEU 492 Ca 0.18 -0.59 -0.01 0.00 0.09 0.00 0.00 57.88 57.55 1ce8 h LEU 492 Cb 0.04 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1ce8 h LEU 492 CO -0.03 1.23 0.07 0.11 0.09 0.00 0.00 178.44 179.91 1ce8 h LYS 493 N 0.35 0.22 -0.33 1.13 1.79 -0.95 -1.39 116.57 117.40 1ce8 h LYS 493 Ca -0.02 -0.04 0.09 0.00 -2.18 0.00 0.00 60.65 58.51 1ce8 h LYS 493 Cb 1.16 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.76 1ce8 h LYS 493 CO 0.11 0.28 0.42 0.00 -1.08 0.00 0.00 179.45 179.18 1ce8 h ARG 494 N 0.11 0.00 -0.49 3.15 3.08 -0.93 0.65 114.38 119.94 1ce8 h ARG 494 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1ce8 h ARG 494 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1ce8 h ARG 494 CO -0.01 0.00 0.00 1.63 -1.07 0.00 0.00 179.97 180.52 1ce8 n LYS 495 N -3.56 2.24 -0.47 0.04 4.76 -0.59 -4.46 118.16 116.12 1ce8 n LYS 495 Ca 0.05 -1.64 0.00 0.00 -2.87 0.00 0.00 58.31 53.86 1ce8 n LYS 495 Cb 0.57 -1.45 0.00 0.00 -1.84 0.00 0.00 35.03 32.31 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 1.06 1.11 3.71 0.72 0.00 0.23 -3.56 105.19 108.45 1ce8 n GLY 496 Ca 0.15 0.00 -0.43 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 -2.00 2.63 -2.67 1.61 3.72 -0.79 -4.45 117.46 115.50 1ce8 n PHE 497 Ca 0.00 0.17 -0.36 0.00 -0.05 0.00 0.00 57.45 57.21 1ce8 n PHE 497 Cb 0.00 -2.61 -0.05 0.00 -0.94 0.00 0.00 39.48 35.88 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 0.74 3.15 0.36 4.37 0.00 -1.26 -4.68 121.76 124.44 1ce8 s ALA 498 Ca 0.73 0.60 0.05 0.00 0.00 0.00 0.00 51.96 53.34 1ce8 s ALA 498 Cb -0.55 -3.22 0.71 0.00 0.00 0.00 0.00 23.12 20.06 1ce8 s ALA 498 CO 0.39 -0.01 1.98 -0.44 0.00 0.00 0.00 175.76 177.68 1ce8 h ASP 499 N 2.78 0.68 0.40 0.00 3.32 -1.93 -0.93 116.42 120.74 1ce8 h ASP 499 Ca -0.48 -0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.48 1ce8 h ASP 499 Cb 1.20 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.59 1ce8 h ASP 499 CO 0.63 0.46 -0.42 0.00 -1.72 0.00 0.00 179.24 178.19 1ce8 h ALA 500 N 1.61 1.29 0.05 3.45 0.00 -1.90 0.17 119.26 123.93 1ce8 h ALA 500 Ca 0.28 -0.38 -0.27 0.00 0.00 0.00 0.00 54.91 54.53 1ce8 h ALA 500 Cb 0.13 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 17.88 1ce8 h ALA 500 CO -0.08 0.53 -1.10 -0.09 0.00 0.00 0.00 179.25 178.51 1ce8 h ARG 501 N 0.02 0.66 -0.72 0.00 9.65 -1.42 -2.38 114.38 120.19 1ce8 h ARG 501 Ca -0.00 -0.77 -0.02 0.00 -1.10 0.00 0.00 59.98 58.08 1ce8 h ARG 501 Cb 0.75 0.24 -0.03 0.00 -1.39 0.00 0.00 29.97 29.53 1ce8 h ARG 501 CO 0.06 1.34 0.36 -0.07 2.80 0.00 0.00 179.97 184.45 1ce8 h LEU 502 N 0.32 0.93 -0.43 3.80 3.38 -1.11 -1.42 115.31 120.78 1ce8 h LEU 502 Ca -0.15 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1ce8 h LEU 502 Cb 1.76 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 42.25 1ce8 h LEU 502 CO 0.21 0.79 0.28 0.00 0.09 0.00 0.00 178.44 179.81 1ce8 h ALA 503 N 1.18 0.55 -0.25 1.53 0.00 -0.65 -0.25 119.26 121.37 1ce8 h ALA 503 Ca 0.25 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.16 1ce8 h ALA 503 Cb 0.10 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1ce8 h ALA 503 CO -0.03 0.02 0.01 0.87 0.00 0.00 0.00 179.25 180.11 1ce8 h LYS 504 N 0.58 0.09 0.00 0.00 1.57 -0.87 0.24 116.57 118.18 1ce8 h LYS 504 Ca 0.16 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.87 1ce8 h LYS 504 Cb -0.04 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 1ce8 h LYS 504 CO -0.03 0.06 -0.27 -0.07 -0.57 0.00 0.00 179.45 178.57 1ce8 h LEU 505 N 0.09 0.00 -2.06 2.94 3.38 -0.91 -2.59 115.31 116.16 1ce8 h LEU 505 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1ce8 h LEU 505 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1ce8 h LEU 505 CO -0.19 0.27 0.00 0.00 0.09 0.00 0.00 178.44 178.61 1ce8 n ALA 506 N -2.49 2.45 -3.30 1.53 0.00 -0.14 -3.97 120.51 114.60 1ce8 n ALA 506 Ca -0.02 -0.84 -0.17 0.00 0.00 0.00 0.00 53.44 52.41 1ce8 n ALA 506 Cb 0.32 -0.87 0.07 0.00 0.00 0.00 0.00 19.45 18.97 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 1.42 -0.27 2.73 0.00 0.00 0.56 -4.44 105.19 105.19 1ce8 n GLY 507 Ca 0.17 0.05 -0.20 0.00 0.00 0.00 0.00 46.02 46.04 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 -4.03 0.00 -3.43 1.61 0.24 0.35 -5.02 118.33 108.05 1ce8 n VAL 508 Ca -0.15 -1.96 -0.33 0.00 -2.04 0.00 0.00 64.34 59.86 1ce8 n VAL 508 Cb 0.61 0.74 -0.05 0.00 -1.47 0.00 0.00 33.84 33.67 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 -3.25 3.84 0.33 7.34 0.52 -1.26 -4.32 118.95 122.14 1ce8 s ARG 509 Ca 0.19 0.31 0.07 0.00 -0.52 0.00 0.00 55.73 55.78 1ce8 s ARG 509 Cb 0.01 -2.79 0.75 0.00 0.52 0.00 0.00 34.95 33.44 1ce8 s ARG 509 CO 0.14 0.40 1.83 1.49 0.02 0.00 0.00 175.30 179.18 1ce8 h GLU 510 N 3.01 0.75 -0.21 3.54 4.81 -1.90 0.12 114.58 124.70 1ce8 h GLU 510 Ca -0.48 -0.04 0.06 0.00 -0.13 0.00 0.00 59.36 58.77 1ce8 h GLU 510 Cb 1.18 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.38 1ce8 h GLU 510 CO 0.68 0.49 0.22 0.00 -0.73 0.00 0.00 179.01 179.68 1ce8 h ALA 511 N 1.60 1.88 -0.06 2.92 0.00 -1.93 0.04 119.26 123.71 1ce8 h ALA 511 Ca 0.50 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 55.19 1ce8 h ALA 511 Cb 0.76 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1ce8 h ALA 511 CO -0.27 -0.33 -0.84 0.93 0.00 0.00 0.00 179.25 178.73 1ce8 h GLU 512 N 0.00 0.50 -0.31 0.00 5.08 -1.14 0.95 114.58 119.66 1ce8 h GLU 512 Ca 0.10 -0.47 -0.02 0.00 -1.00 0.00 0.00 59.36 57.97 1ce8 h GLU 512 Cb 0.55 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 1ce8 h GLU 512 CO -0.00 1.10 0.10 0.82 -1.00 0.00 0.00 179.01 180.04 1ce8 h ILE 513 N 0.32 1.20 0.49 3.13 1.08 -1.03 -0.33 117.51 122.37 1ce8 h ILE 513 Ca -0.06 -0.62 -0.01 0.00 -0.39 0.00 0.00 64.86 63.77 1ce8 h ILE 513 Cb 1.46 1.03 -0.02 0.00 -3.07 0.00 0.00 36.82 36.21 1ce8 h ILE 513 CO 0.15 0.21 -0.51 -0.09 -0.69 0.00 0.00 178.15 177.23 1ce8 h ARG 514 N 0.34 -0.97 -0.98 2.37 2.43 -1.16 -0.58 114.38 115.83 1ce8 h ARG 514 Ca 0.10 0.07 0.24 0.00 -0.81 0.00 0.00 59.98 59.57 1ce8 h ARG 514 Cb 0.23 0.22 -0.12 0.00 -0.42 0.00 0.00 29.97 29.87 1ce8 h ARG 514 CO -0.00 -0.64 0.55 -0.22 -1.51 0.00 0.00 179.97 178.15 1ce8 h LYS 515 N -1.00 0.53 -0.11 0.20 3.64 -0.71 0.39 116.57 119.51 1ce8 h LYS 515 Ca -0.06 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.20 1ce8 h LYS 515 Cb 0.87 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 1ce8 h LYS 515 CO -0.07 0.35 -0.32 1.25 -2.27 0.00 0.00 179.45 178.39 1ce8 h LEU 516 N 0.55 0.22 -0.18 5.20 5.85 -0.41 -1.85 115.31 124.70 1ce8 h LEU 516 Ca 0.63 -0.08 -0.12 0.00 0.84 0.00 0.00 57.88 59.15 1ce8 h LEU 516 Cb 1.18 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.15 1ce8 h LEU 516 CO -0.48 0.54 -0.34 0.03 -0.34 0.00 0.00 178.44 177.85 1ce8 h ARG 517 N 0.20 0.54 -0.70 1.25 3.08 0.13 -2.55 114.38 116.33 1ce8 h ARG 517 Ca 0.03 -0.35 0.08 0.00 0.07 0.00 0.00 59.98 59.80 1ce8 h ARG 517 Cb 0.67 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.72 1ce8 h ARG 517 CO 0.05 0.96 0.46 -0.44 -1.07 0.00 0.00 179.97 179.93 1ce8 h ASP 518 N 0.20 0.60 -0.78 7.04 5.19 -1.01 0.72 116.42 128.38 1ce8 h ASP 518 Ca 0.01 0.01 0.01 0.00 -0.62 0.00 0.00 57.03 56.44 1ce8 h ASP 518 Cb 0.94 -0.12 -0.04 0.00 0.18 0.00 0.00 39.33 40.29 1ce8 h ASP 518 CO 0.08 0.38 0.51 -0.61 -3.12 0.00 0.00 179.24 176.48 1ce8 h GLN 519 N 0.68 1.01 -0.51 3.56 4.15 -1.05 -1.80 115.11 121.14 1ce8 h GLN 519 Ca 0.31 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.67 1ce8 h GLN 519 Cb 0.34 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 27.80 1ce8 h GLN 519 CO -0.10 0.67 0.00 0.66 -1.93 0.00 0.00 178.83 178.12 1ce8 n TYR 520 N -4.55 0.68 -3.84 3.99 4.01 -0.63 -4.90 117.16 111.92 1ce8 n TYR 520 Ca 0.08 -0.34 -0.27 0.00 -0.16 0.00 0.00 57.90 57.21 1ce8 n TYR 520 Cb 0.03 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.09 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 1.15 -3.79 -4.29 7.72 2.03 -0.21 -4.89 116.55 114.27 1ce8 n ASP 521 Ca 0.19 -0.78 -0.45 0.00 0.52 0.00 0.00 54.79 54.27 1ce8 n ASP 521 Cb 0.49 -3.98 -0.04 0.00 -0.72 0.00 0.00 41.12 36.87 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 -7.11 6.42 0.19 -2.67 2.96 0.23 -5.01 118.68 113.70 1ce8 s LEU 522 Ca 0.46 -2.59 0.08 0.00 -0.22 0.00 0.00 54.13 51.86 1ce8 s LEU 522 Cb -0.23 -2.15 -0.04 0.00 0.50 0.00 0.00 46.19 44.27 1ce8 s LEU 522 CO 0.82 -0.58 -0.15 -1.00 -1.32 0.00 0.00 176.35 174.12 1ce8 s HIS 523 N 0.33 1.70 0.84 5.38 3.76 -1.26 -4.52 115.29 121.52 1ce8 s HIS 523 Ca 0.16 -0.55 -0.13 0.00 -0.15 0.00 0.00 55.06 54.39 1ce8 s HIS 523 Cb -0.15 -0.81 0.10 0.00 1.11 0.00 0.00 32.58 32.84 1ce8 s HIS 523 CO -0.06 0.33 1.21 -1.25 -0.85 0.00 0.00 174.74 174.11 1ce8 s PRO 524 N -3.35 1.69 0.37 8.40 0.04 -1.26 -4.83 135.00 136.05 1ce8 s PRO 524 Ca 0.19 0.02 0.08 0.00 0.04 0.00 0.00 61.00 61.34 1ce8 s PRO 524 Cb -0.02 -1.93 -0.07 0.00 0.04 0.00 0.00 34.50 32.52 1ce8 s PRO 524 CO 0.06 -1.77 -0.05 0.14 0.04 0.00 0.00 177.00 175.42 1ce8 s VAL 525 N -3.63 2.12 -0.08 -0.36 -7.23 0.20 -4.91 120.40 106.52 1ce8 s VAL 525 Ca 0.64 -2.12 0.02 0.00 -1.81 0.00 0.00 61.98 58.71 1ce8 s VAL 525 Cb -0.10 -2.78 -0.02 0.00 0.56 0.00 0.00 36.38 34.04 1ce8 s VAL 525 CO 0.50 -0.12 -0.13 -0.31 -0.31 0.00 0.00 175.10 174.73 1ce8 s TYR 526 N -2.67 2.78 0.25 2.82 1.51 -1.26 -1.57 117.35 119.22 1ce8 s TYR 526 Ca 0.33 -0.31 0.09 0.00 -1.01 0.00 0.00 57.07 56.18 1ce8 s TYR 526 Cb 0.05 -1.73 -0.04 0.00 -0.11 0.00 0.00 41.96 40.14 1ce8 s TYR 526 CO 0.17 0.06 0.01 0.15 -1.11 0.00 0.00 175.55 174.83 1ce8 s LYS 527 N -0.33 2.36 0.13 -0.62 -0.14 -0.51 -0.07 119.74 120.57 1ce8 s LYS 527 Ca 0.03 -1.35 0.09 0.00 -1.36 0.00 0.00 55.97 53.38 1ce8 s LYS 527 Cb -0.13 -2.22 -0.04 0.00 -1.68 0.00 0.00 37.83 33.77 1ce8 s LYS 527 CO 0.02 0.38 -0.16 1.03 -0.76 0.00 0.00 175.35 175.87 1ce8 s ARG 528 N -3.60 1.86 0.14 1.68 0.52 -1.26 -1.73 118.95 116.56 1ce8 s ARG 528 Ca 0.31 -1.20 -0.26 0.00 -0.52 0.00 0.00 55.73 54.06 1ce8 s ARG 528 Cb -0.07 -2.13 -0.07 0.00 0.52 0.00 0.00 34.95 33.20 1ce8 s ARG 528 CO 0.20 0.47 0.80 0.08 0.02 0.00 0.00 175.30 176.87 1ce8 s VAL 529 N -1.29 4.43 0.00 3.52 1.01 0.23 -4.95 120.40 123.35 1ce8 s VAL 529 Ca 0.20 1.75 0.00 0.00 0.00 0.00 0.00 61.98 63.93 1ce8 s VAL 529 Cb -0.10 -4.16 0.00 0.00 0.00 0.00 0.00 36.38 32.11 1ce8 s VAL 529 CO 0.12 0.47 0.11 -0.90 0.00 0.00 0.00 175.10 174.89 1ce8 n ASP 530 N 1.94 0.00 0.00 3.32 5.68 -1.26 -4.74 116.55 121.49 1ce8 n ASP 530 Ca -0.04 -1.00 0.00 0.00 -0.50 0.00 0.00 54.79 53.25 1ce8 n ASP 530 Cb 0.49 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.47 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 -1.78 2.12 -2.24 -0.99 -4.67 114.28 106.72 1ce8 n THR 531 Ca 0.00 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.83 1ce8 n THR 531 Cb 0.34 0.00 0.08 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 -0.50 -1.10 -1.14 0.00 0.00 0.11 -1.43 120.51 116.44 1ce8 n ALA 533 Ca 0.09 0.27 -0.05 0.00 0.00 0.00 0.00 53.44 53.76 1ce8 n ALA 533 Cb 0.78 -4.18 -0.02 0.00 0.00 0.00 0.00 19.45 16.03 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 -4.03 -0.07 0.22 0.00 0.00 -1.26 -4.87 120.51 110.50 1ce8 n ALA 534 Ca -0.05 0.08 0.07 0.00 0.00 0.00 0.00 53.44 53.54 1ce8 n ALA 534 Cb 0.58 -1.11 0.52 0.00 0.00 0.00 0.00 19.45 19.44 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 0.24 0.00 -5.35 0.00 4.81 -1.64 -3.43 114.58 109.21 1ce8 h GLU 535 Ca -0.10 0.00 -0.40 0.00 -0.13 0.00 0.00 59.36 58.73 1ce8 h GLU 535 Cb 0.69 0.00 -0.19 0.00 0.63 0.00 0.00 28.75 29.88 1ce8 h GLU 535 CO 0.15 0.23 -0.76 -0.06 -0.73 0.00 0.00 179.01 177.83 1ce8 s PHE 536 N -4.30 1.32 0.77 0.92 0.08 -1.26 -5.14 117.98 110.36 1ce8 s PHE 536 Ca -0.03 -0.55 -0.11 0.00 0.12 0.00 0.00 56.93 56.37 1ce8 s PHE 536 Cb 0.14 -0.70 0.05 0.00 -0.57 0.00 0.00 43.02 41.94 1ce8 s PHE 536 CO 0.67 0.11 1.09 0.00 -0.10 0.00 0.00 175.22 176.98 1ce8 s ALA 537 N -1.98 2.28 -0.01 5.36 0.00 -1.26 -4.95 121.76 121.20 1ce8 s ALA 537 Ca 0.06 0.26 0.03 0.00 0.00 0.00 0.00 51.96 52.31 1ce8 s ALA 537 Cb -0.06 -3.27 -0.01 0.00 0.00 0.00 0.00 23.12 19.79 1ce8 s ALA 537 CO 0.02 -1.73 -0.09 -0.08 0.00 0.00 0.00 175.76 173.88 1ce8 s THR 538 N -2.90 0.75 -2.12 0.00 -1.32 -1.26 -4.49 115.64 104.30 1ce8 s THR 538 Ca 0.61 -0.40 0.18 0.00 -1.21 0.00 0.00 61.69 60.88 1ce8 s THR 538 Cb -0.17 -0.64 0.24 0.00 -1.51 0.00 0.00 72.50 70.42 1ce8 s THR 538 CO 0.56 0.22 1.18 0.47 -2.21 0.00 0.00 174.62 174.83 1ce8 n ASP 539 N 2.92 2.81 -4.91 8.08 8.00 -1.25 -4.95 116.55 127.24 1ce8 n ASP 539 Ca -0.14 -1.83 -0.29 0.00 0.71 0.00 0.00 54.79 53.23 1ce8 n ASP 539 Cb 0.56 -0.10 -0.04 0.00 -0.02 0.00 0.00 41.12 41.53 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 -1.41 5.12 -0.63 -3.53 2.01 -1.26 -5.05 115.64 110.90 1ce8 s THR 540 Ca 0.26 -0.07 0.06 0.00 0.31 0.00 0.00 61.69 62.25 1ce8 s THR 540 Cb 0.17 -3.69 0.23 0.00 0.01 0.00 0.00 72.50 69.22 1ce8 s THR 540 CO 0.24 -0.14 0.67 0.00 -0.69 0.00 0.00 174.62 174.70 1ce8 n ALA 541 N -0.48 3.79 -3.80 7.40 0.00 -1.26 -4.95 120.51 121.21 1ce8 n ALA 541 Ca -0.03 -4.58 -0.35 0.00 0.00 0.00 0.00 53.44 48.47 1ce8 n ALA 541 Cb 0.53 -0.92 -0.12 0.00 0.00 0.00 0.00 19.45 18.95 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 -2.13 3.57 0.35 0.00 5.04 -1.26 -0.81 117.35 122.11 1ce8 s TYR 542 Ca 0.36 -2.55 0.08 0.00 -2.44 0.00 0.00 57.07 52.52 1ce8 s TYR 542 Cb 0.11 -3.18 -0.04 0.00 0.35 0.00 0.00 41.96 39.20 1ce8 s TYR 542 CO -0.05 -0.94 0.13 -1.64 -1.34 0.00 0.00 175.55 171.71 1ce8 s MET 543 N 0.87 2.32 -0.05 4.97 -1.94 0.30 -0.60 119.30 125.17 1ce8 s MET 543 Ca 0.10 -1.61 -0.10 0.00 -1.71 0.00 0.00 55.69 52.37 1ce8 s MET 543 Cb -0.22 -2.12 0.02 0.00 2.01 0.00 0.00 34.83 34.51 1ce8 s MET 543 CO -0.04 0.08 0.24 1.52 -0.01 0.00 0.00 175.02 176.81 1ce8 s TYR 544 N -2.46 -0.17 0.46 -0.03 -0.85 -0.71 0.08 117.35 113.67 1ce8 s TYR 544 Ca 0.38 0.35 -0.02 0.00 -0.52 0.00 0.00 57.07 57.26 1ce8 s TYR 544 Cb -0.01 0.06 -0.02 0.00 0.38 0.00 0.00 41.96 42.37 1ce8 s TYR 544 CO 0.22 -0.26 0.71 -1.54 -1.52 0.00 0.00 175.55 173.17 1ce8 s SER 545 N -0.72 6.00 -0.08 -0.18 1.04 -1.26 -1.42 113.70 117.09 1ce8 s SER 545 Ca -0.08 0.55 -0.32 0.00 0.48 0.00 0.00 55.95 56.58 1ce8 s SER 545 Cb -0.04 -1.85 0.12 0.00 0.10 0.00 0.00 66.02 64.35 1ce8 s SER 545 CO 0.02 -0.64 1.13 0.28 0.98 0.00 0.00 173.24 175.01 1ce8 s THR 546 N -2.62 0.00 -0.93 2.02 -1.32 -0.61 -4.78 115.64 107.40 1ce8 s THR 546 Ca 0.47 -0.12 -0.11 0.00 -1.21 0.00 0.00 61.69 60.72 1ce8 s THR 546 Cb -0.10 -1.32 0.24 0.00 -1.51 0.00 0.00 72.50 69.81 1ce8 s THR 546 CO 0.40 0.00 0.88 -0.31 -2.21 0.00 0.00 174.62 173.39 1ce8 s TYR 547 N -2.67 3.95 0.00 9.09 1.51 -1.26 0.62 117.35 128.60 1ce8 s TYR 547 Ca 0.10 -2.36 0.00 0.00 -1.01 0.00 0.00 57.07 53.80 1ce8 s TYR 547 Cb 0.00 -3.76 0.00 0.00 -0.11 0.00 0.00 41.96 38.09 1ce8 s TYR 547 CO -0.05 -0.95 0.00 -1.91 -1.11 0.00 0.00 175.55 171.53 1ce8 n GLU 548 N 3.36 1.29 -0.05 -0.62 2.13 -1.26 -4.81 120.64 120.68 1ce8 n GLU 548 Ca 0.18 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.97 1ce8 n GLU 548 Cb 0.43 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 32.13 1ce8 n GLU 548 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1ce8 h GLU 549 N 0.00 0.00 -6.11 5.31 4.39 -1.99 -3.43 114.58 112.75 1ce8 h GLU 549 Ca 0.00 0.00 -0.56 0.00 0.34 0.00 0.00 59.36 59.14 1ce8 h GLU 549 Cb 0.00 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.60 1ce8 h GLU 549 CO 0.00 0.00 0.04 -2.00 -1.16 0.00 0.00 179.01 175.89 1ce8 s GLU 550 N -1.89 4.38 -0.20 2.33 2.12 -1.26 -4.98 118.70 119.20 1ce8 s GLU 550 Ca -0.09 0.82 -0.08 0.00 0.36 0.00 0.00 54.97 55.98 1ce8 s GLU 550 Cb 0.01 -3.37 -0.04 0.00 0.26 0.00 0.00 34.13 30.99 1ce8 s GLU 550 CO 0.13 0.29 0.09 0.00 -0.54 0.00 0.00 175.26 175.23 1ce8 n GLU 552 N 3.66 2.69 0.05 0.00 1.02 0.91 -4.63 120.64 124.34 1ce8 n GLU 552 Ca -0.16 -2.49 -0.12 0.00 -0.02 0.00 0.00 57.16 54.37 1ce8 n GLU 552 Cb 0.52 -1.51 -0.07 0.00 -0.02 0.00 0.00 31.44 30.37 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 3.91 -0.03 -6.92 0.62 0.00 -1.94 -3.47 119.26 111.43 1ce8 h ALA 553 Ca 0.00 -0.00 -0.59 0.00 0.00 0.00 0.00 54.91 54.32 1ce8 h ALA 553 Cb 0.94 0.03 -0.16 0.00 0.00 0.00 0.00 17.79 18.60 1ce8 h ALA 553 CO 0.00 -0.52 -0.95 0.09 0.00 0.00 0.00 179.25 177.87 1ce8 n ASN 554 N -5.12 0.37 -4.74 0.00 3.02 -1.26 -4.88 115.26 102.66 1ce8 n ASN 554 Ca -0.07 -1.21 -0.39 0.00 -0.03 0.00 0.00 54.58 52.88 1ce8 n ASN 554 Cb 0.05 -1.99 0.04 0.00 -0.61 0.00 0.00 39.78 37.26 1ce8 n ASN 554 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1ce8 n PRO 555 N -4.56 1.79 -1.95 3.52 -0.05 -1.26 -4.98 135.00 127.52 1ce8 n PRO 555 Ca -0.31 0.65 -0.31 0.00 -0.05 0.00 0.00 63.50 63.47 1ce8 n PRO 555 Cb 0.69 -2.55 0.01 0.00 -0.05 0.00 0.00 33.50 31.60 1ce8 n PRO 555 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 175.50 173.91 1ce8 s SER 556 N -0.80 6.07 -0.08 3.54 1.04 -1.26 -4.98 113.70 117.23 1ce8 s SER 556 Ca 0.69 1.55 0.09 0.00 0.48 0.00 0.00 55.95 58.76 1ce8 s SER 556 Cb -0.43 -2.49 -0.12 0.00 0.10 0.00 0.00 66.02 63.07 1ce8 s SER 556 CO 0.52 -0.98 0.06 0.35 0.98 0.00 0.00 173.24 174.17 1ce8 n THR 557 N -2.47 0.54 0.00 2.02 -2.24 -1.26 -4.77 114.28 106.11 1ce8 n THR 557 Ca 0.07 -0.37 -0.12 0.00 -2.27 0.00 0.00 64.05 61.36 1ce8 n THR 557 Cb 0.54 -0.59 -0.06 0.00 -2.10 0.00 0.00 70.33 68.12 1ce8 n THR 557 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1ce8 h ASP 558 N 0.00 -1.28 -1.46 3.42 5.19 -2.03 -3.47 116.42 116.80 1ce8 h ASP 558 Ca -0.21 0.17 -0.46 0.00 -0.62 0.00 0.00 57.03 55.91 1ce8 h ASP 558 Cb 1.40 0.52 -0.01 0.00 0.18 0.00 0.00 39.33 41.43 1ce8 h ASP 558 CO 0.01 -0.42 -0.32 -0.13 -3.12 0.00 0.00 179.24 175.26 1ce8 s ARG 559 N -5.90 2.66 -0.23 3.56 0.52 -1.26 -5.09 118.95 113.21 1ce8 s ARG 559 Ca -0.15 -1.41 -0.21 0.00 -0.52 0.00 0.00 55.73 53.43 1ce8 s ARG 559 Cb 0.09 -2.56 -0.02 0.00 0.52 0.00 0.00 34.95 32.99 1ce8 s ARG 559 CO 0.64 -0.25 0.68 -1.21 0.02 0.00 0.00 175.30 175.18 1ce8 s GLU 560 N -4.24 4.16 -0.14 3.54 2.02 -1.26 -4.92 118.70 117.86 1ce8 s GLU 560 Ca 0.51 0.66 -0.06 0.00 0.02 0.00 0.00 54.97 56.11 1ce8 s GLU 560 Cb -0.06 -3.63 -0.04 0.00 0.10 0.00 0.00 34.13 30.50 1ce8 s GLU 560 CO 0.30 -0.39 0.07 0.15 0.02 0.00 0.00 175.26 175.42 1ce8 s LYS 561 N 2.40 3.55 -0.13 1.61 1.02 -1.26 -0.31 119.74 126.63 1ce8 s LYS 561 Ca 0.29 -0.30 0.01 0.00 0.02 0.00 0.00 55.97 55.99 1ce8 s LYS 561 Cb -0.16 -3.09 0.02 0.00 -0.52 0.00 0.00 37.83 34.08 1ce8 s LYS 561 CO 0.09 0.53 -0.15 0.42 -0.92 0.00 0.00 175.35 175.32 1ce8 s ILE 562 N -0.37 1.56 -0.16 2.17 -1.09 -0.72 0.17 121.20 122.75 1ce8 s ILE 562 Ca 0.09 -0.65 -0.11 0.00 -2.23 0.00 0.00 60.65 57.75 1ce8 s ILE 562 Cb -0.12 -1.44 -0.05 0.00 -1.58 0.00 0.00 42.46 39.27 1ce8 s ILE 562 CO 0.02 0.45 0.20 -0.32 -1.23 0.00 0.00 174.94 174.06 1ce8 s MET 563 N 1.23 4.08 -0.17 2.79 -2.45 0.27 -0.96 119.30 124.10 1ce8 s MET 563 Ca -0.01 -0.06 0.00 0.00 -1.25 0.00 0.00 55.69 54.37 1ce8 s MET 563 Cb -0.14 -3.38 0.00 0.00 1.25 0.00 0.00 34.83 32.57 1ce8 s MET 563 CO -0.06 0.37 -0.15 0.08 1.05 0.00 0.00 175.02 176.31 1ce8 s VAL 564 N 0.11 2.59 -0.26 10.11 1.01 0.17 -0.48 120.40 133.66 1ce8 s VAL 564 Ca 0.13 -0.79 -0.14 0.00 0.00 0.00 0.00 61.98 61.19 1ce8 s VAL 564 Cb -0.12 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 1ce8 s VAL 564 CO 0.02 0.51 0.32 -0.76 0.00 0.00 0.00 175.10 175.19 1ce8 s LEU 565 N 0.97 4.05 1.01 3.92 1.43 -1.05 -0.50 118.68 128.51 1ce8 s LEU 565 Ca -0.02 0.23 -0.17 0.00 -1.03 0.00 0.00 54.13 53.14 1ce8 s LEU 565 Cb -0.15 -2.34 0.23 0.00 0.03 0.00 0.00 46.19 43.96 1ce8 s LEU 565 CO -0.03 -0.12 1.33 -0.83 0.23 0.00 0.00 176.35 176.93 1ce8 s GLY 566 N 1.55 1.80 -0.03 -3.19 0.00 0.13 -3.24 107.32 104.34 1ce8 s GLY 566 Ca 0.13 -1.28 0.16 0.00 0.00 0.00 0.00 44.72 43.73 1ce8 s GLY 566 CO 0.09 -0.45 1.40 0.61 0.00 0.00 0.00 173.10 174.76 1ce8 n GLY 567 N -3.60 2.79 7.00 0.20 0.00 -1.24 -4.25 105.19 106.10 1ce8 n GLY 567 Ca 0.16 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.56 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 0.85 0.55 3.72 -0.02 0.00 -1.26 -4.75 105.19 104.28 1ce8 n GLY 568 Ca 0.18 -0.83 -0.34 0.00 0.00 0.00 0.00 46.02 45.04 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 2.07 0.33 1.61 0.04 -1.26 -4.42 135.00 133.36 1ce8 s PRO 569 Ca 0.00 1.68 -0.26 0.00 0.04 0.00 0.00 61.00 62.46 1ce8 s PRO 569 Cb 0.00 -1.83 -0.10 0.00 0.04 0.00 0.00 34.50 32.61 1ce8 s PRO 569 CO 0.00 -1.87 0.96 -0.80 0.04 0.00 0.00 177.00 175.32 1ce8 s ASN 570 N -2.20 7.30 0.10 6.66 0.02 -1.26 -4.92 114.94 120.64 1ce8 s ASN 570 Ca 0.72 1.86 -0.11 0.00 -1.02 0.00 0.00 52.86 54.32 1ce8 s ASN 570 Cb -0.27 -2.58 0.01 0.00 0.02 0.00 0.00 41.25 38.43 1ce8 s ASN 570 CO 0.47 -0.10 0.25 -0.13 0.02 0.00 0.00 177.10 177.61 1ce8 s ARG 571 N -2.06 0.91 0.02 -0.60 3.00 -1.08 -3.33 118.95 115.83 1ce8 s ARG 571 Ca 0.50 -0.89 -0.32 0.00 0.00 0.00 0.00 55.73 55.03 1ce8 s ARG 571 Cb -0.19 0.38 -0.11 0.00 0.00 0.00 0.00 34.95 35.03 1ce8 s ARG 571 CO 0.24 -0.31 1.89 -0.89 0.00 0.00 0.00 175.30 176.24 1ce8 n ILE 572 N -0.11 0.58 0.00 1.52 5.41 -1.26 0.10 119.36 125.60 1ce8 n ILE 572 Ca -0.15 -0.10 0.00 0.00 1.00 0.00 0.00 62.75 63.49 1ce8 n ILE 572 Cb 0.63 -2.09 0.00 0.00 -0.71 0.00 0.00 39.64 37.47 1ce8 n ILE 572 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ce8 n GLY 573 N 4.37 2.18 2.51 7.39 0.00 -1.26 -4.89 105.19 115.48 1ce8 n GLY 573 Ca 0.20 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 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 1.99 -0.42 1.61 1.13 0.29 -5.00 117.38 114.97 1ce8 n GLN 574 Ca 0.00 -4.07 0.00 0.00 -1.94 0.00 0.00 57.00 50.99 1ce8 n GLN 574 Cb 0.00 -1.92 0.00 0.00 0.11 0.00 0.00 30.24 28.43 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 0.21 1.22 0.47 1.08 0.00 -1.19 -2.62 105.19 104.36 1ce8 n GLY 575 Ca 0.27 -1.98 0.39 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.14 0.04 -1.04 -0.61 2.10 -1.92 -1.34 117.51 114.61 1ce8 h ILE 576 Ca 0.00 -0.01 0.30 0.00 1.08 0.00 0.00 64.86 66.23 1ce8 h ILE 576 Cb 0.00 0.01 -0.13 0.00 -1.09 0.00 0.00 36.82 35.61 1ce8 h ILE 576 CO 0.00 0.01 0.63 -0.33 -1.08 0.00 0.00 178.15 177.37 1ce8 h GLU 577 N 0.03 0.39 0.05 2.19 3.07 -1.89 -0.37 114.58 118.05 1ce8 h GLU 577 Ca 0.86 -0.02 -0.24 0.00 -0.50 0.00 0.00 59.36 59.46 1ce8 h GLU 577 Cb 2.74 -0.09 0.02 0.00 -0.84 0.00 0.00 28.75 30.59 1ce8 h GLU 577 CO -0.46 0.26 -0.98 0.74 -1.40 0.00 0.00 179.01 177.17 1ce8 h PHE 578 N 0.40 0.88 -0.76 4.33 0.04 -1.51 -3.14 116.94 117.18 1ce8 h PHE 578 Ca 0.68 -0.52 0.10 0.00 2.80 0.00 0.00 57.97 61.04 1ce8 h PHE 578 Cb 1.58 -0.09 -0.08 0.00 2.20 0.00 0.00 35.95 39.57 1ce8 h PHE 578 CO -0.01 1.36 0.39 0.22 -0.60 0.00 0.00 178.31 179.67 1ce8 h ASP 579 N 0.16 0.51 -0.71 2.17 3.58 -1.24 -0.11 116.42 120.78 1ce8 h ASP 579 Ca -0.14 0.06 0.05 0.00 0.42 0.00 0.00 57.03 57.42 1ce8 h ASP 579 Cb 1.67 -0.02 -0.05 0.00 1.72 0.00 0.00 39.33 42.64 1ce8 h ASP 579 CO 0.19 0.28 0.43 0.22 -2.88 0.00 0.00 179.24 177.47 1ce8 h TYR 580 N 0.64 0.79 -0.27 0.28 5.03 -1.27 0.21 116.97 122.38 1ce8 h TYR 580 Ca 0.38 0.02 -0.08 0.00 2.58 0.00 0.00 58.73 61.63 1ce8 h TYR 580 Cb 0.42 -0.25 -0.01 0.00 1.55 0.00 0.00 36.73 38.44 1ce8 h TYR 580 CO -0.10 0.42 -0.15 0.00 -1.32 0.00 0.00 178.16 177.02 1ce8 h VAL 583 N 0.12 0.89 -0.91 0.00 2.07 -0.47 -2.29 116.25 115.66 1ce8 h VAL 583 Ca 0.13 -0.11 0.10 0.00 0.82 0.00 0.00 66.70 67.64 1ce8 h VAL 583 Cb 0.15 0.54 -0.08 0.00 -1.52 0.00 0.00 31.29 30.39 1ce8 h VAL 583 CO -0.19 0.06 0.55 0.45 0.02 0.00 0.00 177.57 178.46 1ce8 h HIS 584 N 0.32 1.00 -0.44 1.57 -0.00 -0.79 0.34 115.15 117.14 1ce8 h HIS 584 Ca 0.19 0.03 -0.06 0.00 -0.00 0.00 0.00 60.37 60.52 1ce8 h HIS 584 Cb 0.16 -0.31 -0.02 0.00 -0.00 0.00 0.00 27.41 27.24 1ce8 h HIS 584 CO -0.14 0.42 0.03 0.00 -0.00 0.00 0.00 177.93 178.24 1ce8 h ALA 585 N 1.48 0.59 0.75 2.45 0.00 -0.88 0.11 119.26 123.76 1ce8 h ALA 585 Ca 0.44 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 1ce8 h ALA 585 Cb 0.38 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.01 1ce8 h ALA 585 CO -0.24 0.35 -0.37 1.03 0.00 0.00 0.00 179.25 180.02 1ce8 h SER 586 N 0.61 -0.89 -0.29 0.00 0.87 -0.68 -1.04 113.55 112.13 1ce8 h SER 586 Ca 0.13 0.03 0.07 0.00 -1.23 0.00 0.00 61.79 60.79 1ce8 h SER 586 Cb 0.45 0.23 -0.08 0.00 -0.44 0.00 0.00 62.40 62.56 1ce8 h SER 586 CO 0.02 -0.62 -0.31 -0.07 -0.53 0.00 0.00 176.83 175.31 1ce8 h LEU 587 N -1.02 -1.02 -0.28 2.23 3.38 -0.95 0.41 115.31 118.06 1ce8 h LEU 587 Ca -0.10 0.17 0.04 0.00 0.09 0.00 0.00 57.88 58.08 1ce8 h LEU 587 Cb 0.79 0.46 -0.04 0.00 0.09 0.00 0.00 40.66 41.97 1ce8 h LEU 587 CO 0.16 -0.33 0.05 0.00 0.09 0.00 0.00 178.44 178.42 1ce8 h ALA 588 N 0.65 0.29 0.00 1.53 0.00 -0.92 -1.96 119.26 118.85 1ce8 h ALA 588 Ca 0.14 0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 1ce8 h ALA 588 Cb 0.53 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1ce8 h ALA 588 CO -0.46 -0.36 -0.55 -0.07 0.00 0.00 0.00 179.25 177.80 1ce8 h LEU 589 N 0.16 0.00 -0.29 0.00 3.38 -0.44 -1.65 115.31 116.47 1ce8 h LEU 589 Ca 0.13 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.05 1ce8 h LEU 589 Cb 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1ce8 h LEU 589 CO -0.18 0.55 -0.01 -0.09 0.09 0.00 0.00 178.44 178.81 1ce8 h ARG 590 N 0.00 0.51 -0.98 1.13 2.43 0.03 -0.57 114.38 116.93 1ce8 h ARG 590 Ca -0.01 -0.17 0.08 0.00 -0.81 0.00 0.00 59.98 59.08 1ce8 h ARG 590 Cb 1.24 -0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 30.68 1ce8 h ARG 590 CO 0.07 0.67 0.63 1.49 -1.51 0.00 0.00 179.97 181.32 1ce8 h GLU 591 N 0.29 1.04 0.00 0.20 4.81 -1.32 0.66 114.58 120.28 1ce8 h GLU 591 Ca 0.08 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1ce8 h GLU 591 Cb 0.44 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.59 1ce8 h GLU 591 CO 0.02 0.69 0.00 -0.44 -0.73 0.00 0.00 179.01 178.55 1ce8 h ASP 592 N 1.08 0.00 0.00 1.04 5.19 -0.29 -3.45 116.42 119.99 1ce8 h ASP 592 Ca 0.44 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.85 1ce8 h ASP 592 Cb 0.28 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.79 1ce8 h ASP 592 CO -0.19 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 176.54 1ce8 n GLY 593 N -0.60 0.89 3.86 2.75 0.00 0.23 -5.06 105.19 107.25 1ce8 n GLY 593 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.00 3.46 -0.35 1.61 2.02 -0.32 -4.74 117.35 117.02 1ce8 s TYR 594 Ca 0.00 1.28 -0.24 0.00 -0.37 0.00 0.00 57.07 57.74 1ce8 s TYR 594 Cb 0.00 -2.64 0.01 0.00 -0.40 0.00 0.00 41.96 38.93 1ce8 s TYR 594 CO 0.00 -0.24 0.84 -2.00 -1.57 0.00 0.00 175.55 172.58 1ce8 s GLU 595 N -3.93 3.83 -0.10 -0.62 2.12 0.58 -4.22 118.70 116.36 1ce8 s GLU 595 Ca 0.56 0.47 -0.11 0.00 0.36 0.00 0.00 54.97 56.25 1ce8 s GLU 595 Cb -0.10 -3.79 -0.05 0.00 0.26 0.00 0.00 34.13 30.45 1ce8 s GLU 595 CO 0.31 -0.85 0.24 0.95 -0.54 0.00 0.00 175.26 175.37 1ce8 s THR 596 N 3.21 5.33 -0.17 -1.70 -4.23 -1.26 -1.76 115.64 115.06 1ce8 s THR 596 Ca 0.34 0.45 0.01 0.00 -1.18 0.00 0.00 61.69 61.31 1ce8 s THR 596 Cb -0.13 -3.54 0.01 0.00 1.34 0.00 0.00 72.50 70.19 1ce8 s THR 596 CO 0.17 0.55 -0.18 -0.63 -0.54 0.00 0.00 174.62 173.98 1ce8 s ILE 597 N -0.64 2.26 -0.14 2.99 1.01 -0.13 -1.12 121.20 125.43 1ce8 s ILE 597 Ca 0.17 -0.88 -0.04 0.00 0.00 0.00 0.00 60.65 59.90 1ce8 s ILE 597 Cb -0.13 -1.95 -0.03 0.00 0.01 0.00 0.00 42.46 40.35 1ce8 s ILE 597 CO 0.06 0.53 -0.00 -0.32 0.00 0.00 0.00 174.94 175.20 1ce8 s MET 598 N 1.18 3.55 -0.27 2.79 1.75 0.54 0.46 119.30 129.31 1ce8 s MET 598 Ca 0.02 -0.44 0.00 0.00 -1.25 0.00 0.00 55.69 54.02 1ce8 s MET 598 Cb -0.14 -2.95 0.05 0.00 2.84 0.00 0.00 34.83 34.63 1ce8 s MET 598 CO -0.09 0.38 -0.07 0.08 -0.65 0.00 0.00 175.02 174.68 1ce8 s VAL 599 N 0.01 2.57 0.07 10.11 1.01 0.34 -0.47 120.40 134.04 1ce8 s VAL 599 Ca 0.03 -1.39 -0.27 0.00 0.00 0.00 0.00 61.98 60.34 1ce8 s VAL 599 Cb -0.13 -2.44 0.08 0.00 0.00 0.00 0.00 36.38 33.90 1ce8 s VAL 599 CO 0.02 0.02 0.93 0.21 0.00 0.00 0.00 175.10 176.28 1ce8 s ASN 600 N 1.21 -0.27 -0.01 3.32 2.47 -0.99 -0.69 114.94 119.98 1ce8 s ASN 600 Ca -0.05 -0.20 0.19 0.00 0.42 0.00 0.00 52.86 53.22 1ce8 s ASN 600 Cb -0.19 0.43 0.31 0.00 -1.45 0.00 0.00 41.25 40.35 1ce8 s ASN 600 CO -0.04 -0.75 1.13 0.00 -3.72 0.00 0.00 177.10 173.72 1ce8 s ASN 602 N -1.77 6.15 0.55 0.00 3.84 -1.26 -1.58 114.94 120.87 1ce8 s ASN 602 Ca 0.25 -0.11 0.31 0.00 0.21 0.00 0.00 52.86 53.52 1ce8 s ASN 602 Cb 0.28 -2.18 1.56 0.00 -0.55 0.00 0.00 41.25 40.36 1ce8 s ASN 602 CO -0.12 -0.24 2.09 1.55 -2.79 0.00 0.00 177.10 177.59 1ce8 h PRO 603 N 8.39 0.00 0.00 0.43 0.13 -1.91 -3.18 132.00 135.87 1ce8 h PRO 603 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1ce8 h PRO 603 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1ce8 h PRO 603 CO 0.65 0.09 0.00 0.93 -0.23 0.00 0.00 178.00 179.43 1ce8 h GLU 604 N 0.00 0.00 -6.25 0.86 5.08 -1.89 -3.41 114.58 108.97 1ce8 h GLU 604 Ca -0.00 0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 57.90 1ce8 h GLU 604 Cb 0.34 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1ce8 h GLU 604 CO 0.01 0.00 -0.40 0.95 -1.00 0.00 0.00 179.01 178.57 1ce8 s THR 605 N -3.23 4.53 0.31 1.13 -4.23 -1.20 -2.69 115.64 110.26 1ce8 s THR 605 Ca 0.07 -1.06 0.07 0.00 -1.18 0.00 0.00 61.69 59.60 1ce8 s THR 605 Cb 0.08 -3.57 0.05 0.00 1.34 0.00 0.00 72.50 70.41 1ce8 s THR 605 CO 0.62 -0.24 1.73 0.58 -0.54 0.00 0.00 174.62 176.77 1ce8 h VAL 606 N 1.08 1.29 -0.20 2.29 2.07 -1.90 -2.37 116.25 118.51 1ce8 h VAL 606 Ca -0.48 -1.42 0.06 0.00 0.82 0.00 0.00 66.70 65.67 1ce8 h VAL 606 Cb 1.24 1.63 -0.01 0.00 -1.52 0.00 0.00 31.29 32.64 1ce8 h VAL 606 CO 0.57 0.43 0.17 0.77 0.02 0.00 0.00 177.57 179.52 1ce8 h SER 607 N 0.19 0.00 -0.58 0.57 4.64 -1.91 -0.08 113.55 116.38 1ce8 h SER 607 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1ce8 h SER 607 Cb 0.76 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 1ce8 h SER 607 CO 0.06 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.37 1ce8 n THR 608 N -4.21 2.70 -3.23 2.95 -2.24 -0.89 -4.88 114.28 104.47 1ce8 n THR 608 Ca 0.02 -1.38 -0.39 0.00 -2.27 0.00 0.00 64.05 60.03 1ce8 n THR 608 Cb 0.31 -0.26 -0.06 0.00 -2.10 0.00 0.00 70.33 68.21 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 -0.78 6.66 0.53 3.42 -1.08 -0.04 -4.95 116.67 120.43 1ce8 s ASP 609 Ca 0.54 0.79 0.30 0.00 -0.52 0.00 0.00 52.55 53.66 1ce8 s ASP 609 Cb 0.41 -2.31 1.46 0.00 -1.46 0.00 0.00 42.92 41.02 1ce8 s ASP 609 CO 0.16 -0.13 1.91 0.10 0.52 0.00 0.00 175.17 177.73 1ce8 h TYR 610 N 7.15 0.02 0.00 -5.34 -0.00 -1.89 -0.84 116.97 116.07 1ce8 h TYR 610 Ca -0.36 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.35 1ce8 h TYR 610 Cb 1.16 -0.01 -0.00 0.00 0.00 0.00 0.00 36.73 37.89 1ce8 h TYR 610 CO 0.67 0.00 -0.06 -0.44 -0.00 0.00 0.00 178.16 178.34 1ce8 h ASP 611 N 0.01 0.00 0.77 0.10 3.32 -1.92 -3.25 116.42 115.45 1ce8 h ASP 611 Ca 0.40 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.39 1ce8 h ASP 611 Cb 1.58 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.12 1ce8 h ASP 611 CO -0.01 0.06 -0.26 0.74 -1.72 0.00 0.00 179.24 178.04 1ce8 h THR 612 N 0.00 0.70 -4.44 0.35 2.02 -1.40 -3.46 112.91 106.67 1ce8 h THR 612 Ca -0.00 -1.16 -0.31 0.00 0.77 0.00 0.00 66.41 65.72 1ce8 h THR 612 Cb 0.51 1.74 -0.12 0.00 -1.74 0.00 0.00 68.15 68.55 1ce8 h THR 612 CO 0.01 0.26 -0.39 -0.94 0.37 0.00 0.00 175.52 174.83 1ce8 s SER 613 N -6.30 0.86 0.05 4.18 1.04 -1.23 -4.32 113.70 107.98 1ce8 s SER 613 Ca -0.00 -1.49 -0.15 0.00 0.48 0.00 0.00 55.95 54.78 1ce8 s SER 613 Cb 0.11 0.55 -0.28 0.00 0.10 0.00 0.00 66.02 66.50 1ce8 s SER 613 CO 0.65 -1.09 1.10 0.44 0.98 0.00 0.00 173.24 175.32 1ce8 h ASP 614 N 2.26 0.86 -3.38 7.02 3.32 -1.55 -3.45 116.42 121.50 1ce8 h ASP 614 Ca -0.29 -0.82 -0.45 0.00 0.02 0.00 0.00 57.03 55.50 1ce8 h ASP 614 Cb 1.24 -0.27 -0.35 0.00 0.22 0.00 0.00 39.33 40.17 1ce8 h ASP 614 CO 0.41 1.58 -0.78 -0.13 -1.72 0.00 0.00 179.24 178.60 1ce8 s ARG 615 N -3.01 1.05 -0.24 3.56 0.52 -0.28 -4.55 118.95 116.00 1ce8 s ARG 615 Ca -0.10 -0.14 -0.02 0.00 -0.52 0.00 0.00 55.73 54.95 1ce8 s ARG 615 Cb 0.05 -1.07 0.02 0.00 0.52 0.00 0.00 34.95 34.47 1ce8 s ARG 615 CO 0.92 -0.13 -0.07 -1.17 0.02 0.00 0.00 175.30 174.88 1ce8 s LEU 616 N 1.17 3.06 -0.46 2.53 2.96 0.01 -0.34 118.68 127.62 1ce8 s LEU 616 Ca -0.07 -0.77 -0.14 0.00 -0.22 0.00 0.00 54.13 52.94 1ce8 s LEU 616 Cb -0.14 -1.67 0.07 0.00 0.50 0.00 0.00 46.19 44.96 1ce8 s LEU 616 CO -0.01 -0.10 0.36 -0.31 -1.32 0.00 0.00 176.35 174.97 1ce8 s TYR 617 N 1.35 3.27 -1.27 5.38 1.51 0.38 -0.54 117.35 127.42 1ce8 s TYR 617 Ca 0.02 -1.07 -0.16 0.00 -1.01 0.00 0.00 57.07 54.84 1ce8 s TYR 617 Cb -0.16 -3.13 0.11 0.00 -0.11 0.00 0.00 41.96 38.67 1ce8 s TYR 617 CO -0.05 -0.81 1.65 0.34 -1.11 0.00 0.00 175.55 175.57 1ce8 n PHE 618 N 5.14 4.71 -4.19 2.71 -0.00 0.11 -2.34 117.46 123.60 1ce8 n PHE 618 Ca -0.12 -3.04 -0.12 0.00 -0.00 0.00 0.00 57.45 54.18 1ce8 n PHE 618 Cb 0.43 -2.45 -0.10 0.00 -0.00 0.00 0.00 39.48 37.36 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 3.10 0.97 0.30 -4.13 0.41 -1.04 -4.61 118.70 113.70 1ce8 s GLU 619 Ca 0.49 -1.44 -0.30 0.00 -0.41 0.00 0.00 54.97 53.31 1ce8 s GLU 619 Cb 0.02 -0.13 -0.12 0.00 -1.78 0.00 0.00 34.13 32.13 1ce8 s GLU 619 CO 0.04 -0.12 1.60 -2.30 -0.49 0.00 0.00 175.26 173.99 1ce8 n PRO 620 N -0.14 2.73 -2.38 0.39 -0.02 -1.26 -3.58 135.00 130.75 1ce8 n PRO 620 Ca -0.08 0.97 -0.43 0.00 -2.02 0.00 0.00 63.50 61.94 1ce8 n PRO 620 Cb 0.62 -2.75 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 1ce8 n PRO 620 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1ce8 n VAL 621 N 2.00 4.20 -4.50 -1.45 0.31 -1.26 -4.49 118.33 113.14 1ce8 n VAL 621 Ca 0.08 -4.27 -0.25 0.00 -0.01 0.00 0.00 64.34 59.89 1ce8 n VAL 621 Cb 0.37 -2.41 -0.10 0.00 -0.91 0.00 0.00 33.84 30.79 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 1.11 2.38 0.19 2.52 -4.23 -1.26 -4.85 115.64 111.50 1ce8 s THR 622 Ca 0.42 -2.33 -0.12 0.00 -1.18 0.00 0.00 61.69 58.48 1ce8 s THR 622 Cb 0.08 -2.44 0.11 0.00 1.34 0.00 0.00 72.50 71.59 1ce8 s THR 622 CO -0.00 -0.32 1.85 0.25 -0.54 0.00 0.00 174.62 175.85 1ce8 h LEU 623 N 2.17 0.77 0.63 4.79 5.85 -1.96 0.19 115.31 127.74 1ce8 h LEU 623 Ca -0.41 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.25 1ce8 h LEU 623 Cb 1.26 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 1ce8 h LEU 623 CO 0.64 0.58 -0.48 -0.08 -0.34 0.00 0.00 178.44 178.76 1ce8 h GLU 624 N 0.89 -1.03 -0.44 1.25 4.81 -1.95 0.24 114.58 118.34 1ce8 h GLU 624 Ca 0.24 0.07 0.05 0.00 -0.13 0.00 0.00 59.36 59.58 1ce8 h GLU 624 Cb -0.07 0.23 -0.04 0.00 0.63 0.00 0.00 28.75 29.50 1ce8 h GLU 624 CO -0.05 -0.68 0.19 -0.44 -0.73 0.00 0.00 179.01 177.30 1ce8 h ASP 625 N -1.07 0.24 -0.57 1.04 3.32 -1.77 -2.48 116.42 115.13 1ce8 h ASP 625 Ca -0.08 0.04 -0.10 0.00 0.02 0.00 0.00 57.03 56.91 1ce8 h ASP 625 Cb 0.88 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.41 1ce8 h ASP 625 CO 0.02 0.18 -0.01 0.58 -1.72 0.00 0.00 179.24 178.30 1ce8 h VAL 626 N 0.38 1.26 -0.57 -1.35 2.07 -0.61 -2.78 116.25 114.65 1ce8 h VAL 626 Ca 0.20 -1.15 -0.06 0.00 0.82 0.00 0.00 66.70 66.51 1ce8 h VAL 626 Cb 0.15 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1ce8 h VAL 626 CO -0.17 0.41 0.12 -0.07 0.02 0.00 0.00 177.57 177.88 1ce8 h LEU 627 N 0.95 0.85 -1.55 2.57 3.38 -0.70 -0.56 115.31 120.24 1ce8 h LEU 627 Ca 0.17 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1ce8 h LEU 627 Cb 0.55 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1ce8 h LEU 627 CO 0.03 0.84 -0.01 -0.33 0.09 0.00 0.00 178.44 179.06 1ce8 h GLU 628 N 0.86 0.27 0.03 1.13 4.39 -1.21 -0.85 114.58 119.20 1ce8 h GLU 628 Ca 0.18 -0.04 -0.10 0.00 0.34 0.00 0.00 59.36 59.74 1ce8 h GLU 628 Cb 0.34 -0.05 0.01 0.00 -0.10 0.00 0.00 28.75 28.95 1ce8 h GLU 628 CO 0.00 0.31 -0.41 0.82 -1.16 0.00 0.00 179.01 178.57 1ce8 h ILE 629 N 0.27 1.55 -0.74 3.13 2.04 -1.15 -3.23 117.51 119.38 1ce8 h ILE 629 Ca 0.06 -2.15 0.09 0.00 1.00 0.00 0.00 64.86 63.86 1ce8 h ILE 629 Cb 0.20 2.91 -0.05 0.00 -0.74 0.00 0.00 36.82 39.14 1ce8 h ILE 629 CO 0.01 0.60 0.49 0.58 0.00 0.00 0.00 178.15 179.82 1ce8 h VAL 630 N -0.45 0.95 -0.84 1.67 2.07 -0.81 0.72 116.25 119.56 1ce8 h VAL 630 Ca -0.06 -0.23 0.13 0.00 0.82 0.00 0.00 66.70 67.37 1ce8 h VAL 630 Cb 1.21 0.23 -0.09 0.00 -1.52 0.00 0.00 31.29 31.11 1ce8 h VAL 630 CO 0.08 0.12 0.44 -0.09 0.02 0.00 0.00 177.57 178.14 1ce8 h ARG 631 N 0.66 0.63 0.00 1.57 2.43 -1.18 0.45 114.38 118.95 1ce8 h ARG 631 Ca 0.34 -0.04 -0.26 0.00 -0.81 0.00 0.00 59.98 59.21 1ce8 h ARG 631 Cb 0.44 -0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 29.80 1ce8 h ARG 631 CO -0.12 0.42 -2.15 0.44 -1.51 0.00 0.00 179.97 177.05 1ce8 n ILE 632 N -4.85 1.06 0.09 1.20 -5.35 -0.60 -4.48 119.36 106.42 1ce8 n ILE 632 Ca 0.16 -0.75 -0.11 0.00 -0.27 0.00 0.00 62.75 61.78 1ce8 n ILE 632 Cb 0.40 -0.42 -0.09 0.00 -1.74 0.00 0.00 39.64 37.79 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 0.00 0.17 -6.41 6.28 4.39 -0.61 -3.47 114.58 114.93 1ce8 h GLU 633 Ca -0.36 -0.25 -0.48 0.00 0.34 0.00 0.00 59.36 58.60 1ce8 h GLU 633 Cb 1.87 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 30.60 1ce8 h GLU 633 CO 0.03 1.08 -0.90 1.63 -1.16 0.00 0.00 179.01 179.69 1ce8 n LYS 634 N -3.52 -2.97 -0.91 2.33 5.02 0.12 -4.89 118.16 113.34 1ce8 n LYS 634 Ca -0.04 0.43 -0.32 0.00 -2.02 0.00 0.00 58.31 56.35 1ce8 n LYS 634 Cb 0.93 -4.47 0.14 0.00 -0.02 0.00 0.00 35.03 31.62 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 -6.40 1.36 0.06 1.97 0.04 -1.26 -4.84 135.00 125.92 1ce8 s PRO 635 Ca 0.10 1.60 -0.17 0.00 0.04 0.00 0.00 61.00 62.58 1ce8 s PRO 635 Cb -0.04 -1.76 -0.16 0.00 0.04 0.00 0.00 34.50 32.58 1ce8 s PRO 635 CO 0.88 -2.39 1.28 -0.22 0.04 0.00 0.00 177.00 176.59 1ce8 h LYS 636 N -1.42 0.55 -3.32 4.56 3.64 0.13 -3.45 116.57 117.26 1ce8 h LYS 636 Ca -0.44 -0.40 -0.06 0.00 -1.27 0.00 0.00 60.65 58.47 1ce8 h LYS 636 Cb 1.28 0.07 -0.14 0.00 -0.41 0.00 0.00 32.23 33.02 1ce8 h LYS 636 CO 0.44 1.02 -0.11 0.20 -2.27 0.00 0.00 179.45 178.73 1ce8 s GLY 637 N -3.84 -0.24 -0.08 5.01 0.00 -0.84 -4.78 107.32 102.55 1ce8 s GLY 637 Ca -0.13 0.00 0.03 0.00 0.00 0.00 0.00 44.72 44.63 1ce8 s GLY 637 CO 0.82 -0.25 -0.17 0.14 0.00 0.00 0.00 173.10 173.64 1ce8 s VAL 638 N -3.39 1.53 -0.27 1.40 1.01 0.11 -0.57 120.40 120.21 1ce8 s VAL 638 Ca 0.01 -0.71 -0.08 0.00 0.00 0.00 0.00 61.98 61.19 1ce8 s VAL 638 Cb 0.01 -1.35 -0.02 0.00 0.00 0.00 0.00 36.38 35.02 1ce8 s VAL 638 CO -0.09 0.44 0.11 -0.63 0.00 0.00 0.00 175.10 174.93 1ce8 s ILE 639 N 0.51 4.48 -1.11 2.22 1.01 0.37 -0.78 121.20 127.90 1ce8 s ILE 639 Ca -0.16 -0.23 0.09 0.00 0.00 0.00 0.00 60.65 60.35 1ce8 s ILE 639 Cb -0.17 -3.16 0.06 0.00 0.01 0.00 0.00 42.46 39.20 1ce8 s ILE 639 CO 0.06 0.24 0.76 1.33 0.00 0.00 0.00 174.94 177.33 1ce8 n VAL 640 N 4.95 0.00 1.25 2.92 0.24 -1.26 -2.52 118.33 123.91 1ce8 n VAL 640 Ca -0.15 -0.48 0.13 0.00 -2.04 0.00 0.00 64.34 61.80 1ce8 n VAL 640 Cb 0.51 1.18 0.35 0.00 -1.47 0.00 0.00 33.84 34.41 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 0.38 1.94 -0.04 7.34 3.00 -1.26 -3.56 117.38 125.17 1ce8 n GLN 641 Ca 0.05 -1.37 -0.02 0.00 -0.01 0.00 0.00 57.00 55.66 1ce8 n GLN 641 Cb 0.23 -1.47 -0.14 0.00 0.00 0.00 0.00 30.24 28.85 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 0.65 0.25 1.30 1.08 4.02 -1.26 -2.46 117.16 120.74 1ce8 n TYR 642 Ca 0.17 0.08 0.02 0.00 -0.01 0.00 0.00 57.90 58.17 1ce8 n TYR 642 Cb 0.45 -0.88 0.08 0.00 -0.02 0.00 0.00 39.34 38.96 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 1.52 0.16 4.62 2.72 0.00 -1.20 -4.47 105.19 108.55 1ce8 n GLY 643 Ca -0.19 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 0.65 -1.72 0.37 -0.02 0.00 -1.26 -3.65 105.19 99.56 1ce8 n GLY 644 Ca 0.06 -1.57 0.09 0.00 0.00 0.00 0.00 46.02 44.60 1ce8 n GLY 644 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1ce8 h GLN 645 N 0.00 0.83 0.68 1.61 4.15 -1.95 -2.71 115.11 117.72 1ce8 h GLN 645 Ca 0.00 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.34 1ce8 h GLN 645 Cb 0.00 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.49 1ce8 h GLN 645 CO 0.00 0.55 -0.48 1.15 -1.93 0.00 0.00 178.83 178.12 1ce8 h THR 646 N 0.86 0.04 -0.19 2.39 2.02 -1.86 -0.28 112.91 115.90 1ce8 h THR 646 Ca 0.48 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.55 1ce8 h THR 646 Cb 0.61 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 1ce8 h THR 646 CO -0.25 0.00 -0.36 1.55 0.37 0.00 0.00 175.52 176.84 1ce8 h PRO 647 N -1.11 0.40 -0.94 6.66 0.13 -1.74 -2.85 132.00 132.55 1ce8 h PRO 647 Ca -0.09 -0.18 0.05 0.00 -0.87 0.00 0.00 66.00 64.91 1ce8 h PRO 647 Cb 0.91 -0.01 -0.06 0.00 0.13 0.00 0.00 31.00 31.97 1ce8 h PRO 647 CO 0.05 0.70 0.60 1.25 -0.23 0.00 0.00 178.00 180.37 1ce8 h LEU 648 N 0.34 0.98 -0.45 1.56 5.85 -1.29 -0.27 115.31 122.03 1ce8 h LEU 648 Ca 0.04 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1ce8 h LEU 648 Cb 0.79 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.61 1ce8 h LEU 648 CO 0.06 0.65 0.00 0.29 -0.34 0.00 0.00 178.44 179.10 1ce8 n LYS 649 N -4.52 0.13 0.06 1.25 5.02 -0.13 -2.70 118.16 117.26 1ce8 n LYS 649 Ca 0.13 0.36 0.12 0.00 -2.02 0.00 0.00 58.31 56.90 1ce8 n LYS 649 Cb 0.13 -1.74 0.08 0.00 -0.02 0.00 0.00 35.03 33.48 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 -1.98 0.71 -0.30 -0.35 4.77 -0.12 -4.58 117.00 115.14 1ce8 n LEU 650 Ca 0.03 0.19 -0.08 0.00 -0.03 0.00 0.00 56.01 56.12 1ce8 n LEU 650 Cb 0.21 -0.12 -0.07 0.00 -2.33 0.00 0.00 43.42 41.11 1ce8 n LEU 650 CO 0.18 -0.07 0.41 0.00 -1.33 0.00 0.00 177.39 176.58 1ce8 n ALA 651 N -1.93 -0.46 -0.13 -1.18 0.00 -1.10 -1.08 120.51 114.64 1ce8 n ALA 651 Ca 0.02 0.61 -0.08 0.00 0.00 0.00 0.00 53.44 53.99 1ce8 n ALA 651 Cb 0.47 -0.03 0.01 0.00 0.00 0.00 0.00 19.45 19.89 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 0.50 -0.40 0.00 3.08 -1.83 0.53 114.38 116.26 1ce8 h ARG 652 Ca 0.11 -0.03 -0.06 0.00 0.07 0.00 0.00 59.98 60.08 1ce8 h ARG 652 Cb 0.29 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1ce8 h ARG 652 CO -0.67 0.33 0.00 0.00 -1.07 0.00 0.00 179.97 178.56 1ce8 h ALA 653 N 1.16 1.26 0.03 0.04 0.00 -1.63 -0.04 119.26 120.08 1ce8 h ALA 653 Ca 0.15 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1ce8 h ALA 653 Cb -0.03 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1ce8 h ALA 653 CO -0.05 0.50 -0.01 -0.07 0.00 0.00 0.00 179.25 179.61 1ce8 h LEU 654 N 0.61 -0.03 -0.62 0.00 3.38 -0.54 -1.53 115.31 116.57 1ce8 h LEU 654 Ca 0.13 -0.28 0.05 0.00 0.09 0.00 0.00 57.88 57.87 1ce8 h LEU 654 Cb 0.38 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.09 1ce8 h LEU 654 CO 0.01 0.26 0.35 -0.08 0.09 0.00 0.00 178.44 179.07 1ce8 h GLU 655 N -0.33 0.65 -0.10 1.13 4.81 -0.76 -0.70 114.58 119.29 1ce8 h GLU 655 Ca -0.00 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1ce8 h GLU 655 Cb 0.31 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 1ce8 h GLU 655 CO 0.01 0.43 0.01 0.00 -0.73 0.00 0.00 179.01 178.72 1ce8 h ALA 656 N 1.31 1.83 -0.33 2.92 0.00 -0.85 -1.16 119.26 122.98 1ce8 h ALA 656 Ca 0.27 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1ce8 h ALA 656 Cb 0.13 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1ce8 h ALA 656 CO -0.16 0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.23 1ce8 n ALA 657 N -2.52 2.45 -0.18 0.00 0.00 -0.41 -4.89 120.51 114.96 1ce8 n ALA 657 Ca -0.01 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.82 1ce8 n ALA 657 Cb 0.13 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.60 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 1.07 0.70 3.70 0.00 0.00 -0.44 -5.06 105.19 105.15 1ce8 n GLY 658 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.24 3.12 -1.22 1.61 1.01 -0.40 -4.91 120.40 117.38 1ce8 s VAL 659 Ca 0.00 0.63 -0.19 0.00 0.00 0.00 0.00 61.98 62.42 1ce8 s VAL 659 Cb 0.00 -3.41 -0.01 0.00 0.00 0.00 0.00 36.38 32.96 1ce8 s VAL 659 CO 0.00 0.01 1.90 -0.81 0.00 0.00 0.00 175.10 176.20 1ce8 n PRO 660 N 5.18 2.43 -2.42 2.72 -0.04 -1.26 -4.38 135.00 137.23 1ce8 n PRO 660 Ca 0.15 -2.73 -0.43 0.00 -0.04 0.00 0.00 63.50 60.45 1ce8 n PRO 660 Cb 0.41 -3.45 -0.02 0.00 -0.04 0.00 0.00 33.50 30.39 1ce8 n PRO 660 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1ce8 s VAL 661 N 6.20 4.27 0.49 0.52 1.01 -1.26 0.04 120.40 131.67 1ce8 s VAL 661 Ca 0.58 1.54 0.05 0.00 0.00 0.00 0.00 61.98 64.15 1ce8 s VAL 661 Cb 0.06 -4.00 0.03 0.00 0.00 0.00 0.00 36.38 32.47 1ce8 s VAL 661 CO 0.07 -0.13 0.68 0.27 0.00 0.00 0.00 175.10 175.99 1ce8 s ILE 662 N 3.47 2.80 0.00 2.22 -4.36 0.04 -4.83 121.20 120.54 1ce8 s ILE 662 Ca 0.55 -0.85 0.00 0.00 -0.26 0.00 0.00 60.65 60.09 1ce8 s ILE 662 Cb -0.22 -2.95 0.00 0.00 1.25 0.00 0.00 42.46 40.54 1ce8 s ILE 662 CO 0.15 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.94 1ce8 n GLY 663 N -2.10 -1.39 3.57 6.27 0.00 -1.26 -4.67 105.19 105.61 1ce8 n GLY 663 Ca 0.09 -1.28 -0.55 0.00 0.00 0.00 0.00 46.02 44.27 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 -0.06 0.24 -1.62 2.61 -1.04 -0.70 -4.83 114.28 108.88 1ce8 n THR 664 Ca 0.00 -0.12 -0.38 0.00 -2.04 0.00 0.00 64.05 61.51 1ce8 n THR 664 Cb 0.00 -1.30 0.04 0.00 -1.82 0.00 0.00 70.33 67.25 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 7.16 1.00 -0.12 8.00 3.41 -1.26 -4.74 113.62 127.07 1ce8 n SER 665 Ca 0.35 0.86 0.10 0.00 -0.26 0.00 0.00 58.87 59.92 1ce8 n SER 665 Cb 0.15 -1.40 0.45 0.00 -0.26 0.00 0.00 64.21 63.15 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 0.74 0.50 -0.33 4.33 0.11 -1.92 0.44 132.00 135.86 1ce8 h PRO 666 Ca -0.48 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.50 1ce8 h PRO 666 Cb 1.35 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1ce8 h PRO 666 CO 0.52 0.33 -0.18 0.22 -0.21 0.00 0.00 178.00 178.68 1ce8 h ASP 667 N 0.52 0.74 -0.52 -2.05 3.58 -1.98 -0.70 116.42 116.00 1ce8 h ASP 667 Ca 0.30 -0.42 -0.07 0.00 0.42 0.00 0.00 57.03 57.26 1ce8 h ASP 667 Cb 0.48 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 41.30 1ce8 h ASP 667 CO -0.09 1.00 0.07 0.00 -2.88 0.00 0.00 179.24 177.33 1ce8 h ALA 668 N 0.77 1.05 -0.51 -0.78 0.00 -1.31 0.07 119.26 118.55 1ce8 h ALA 668 Ca 0.07 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1ce8 h ALA 668 Cb 0.73 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1ce8 h ALA 668 CO 0.05 0.60 0.33 0.82 0.00 0.00 0.00 179.25 181.06 1ce8 h ILE 669 N 0.86 1.12 -0.71 0.00 2.04 -0.86 -1.75 117.51 118.20 1ce8 h ILE 669 Ca 0.17 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.78 1ce8 h ILE 669 Cb 0.42 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.85 1ce8 h ILE 669 CO 0.01 0.12 0.37 -0.78 0.00 0.00 0.00 178.15 177.87 1ce8 h ASP 670 N 0.67 0.90 -0.73 1.72 3.58 -0.53 0.26 116.42 122.29 1ce8 h ASP 670 Ca 0.19 -0.08 0.05 0.00 0.42 0.00 0.00 57.03 57.60 1ce8 h ASP 670 Cb -0.06 -0.23 -0.04 0.00 1.72 0.00 0.00 39.33 40.72 1ce8 h ASP 670 CO -0.05 0.74 0.48 -0.09 -2.88 0.00 0.00 179.24 177.44 1ce8 h ARG 671 N 1.00 0.81 0.18 0.28 2.43 -0.11 1.03 114.38 120.00 1ce8 h ARG 671 Ca 0.25 -0.05 -0.28 0.00 -0.81 0.00 0.00 59.98 59.09 1ce8 h ARG 671 Cb 0.06 -0.18 0.02 0.00 -0.42 0.00 0.00 29.97 29.45 1ce8 h ARG 671 CO -0.04 0.54 -1.29 0.00 -1.51 0.00 0.00 179.97 177.67 1ce8 h ALA 672 N 1.59 -0.03 0.00 2.80 0.00 -0.91 0.80 119.26 123.50 1ce8 h ALA 672 Ca 0.30 -0.89 -0.04 0.00 0.00 0.00 0.00 54.91 54.28 1ce8 h ALA 672 Cb 0.13 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1ce8 h ALA 672 CO -0.09 0.66 -0.17 0.93 0.00 0.00 0.00 179.25 180.58 1ce8 h GLU 673 N -0.11 0.00 -5.75 0.00 4.39 -0.07 -3.41 114.58 109.62 1ce8 h GLU 673 Ca -0.24 0.00 -0.62 0.00 0.34 0.00 0.00 59.36 58.83 1ce8 h GLU 673 Cb 1.91 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 30.43 1ce8 h GLU 673 CO 0.18 0.17 0.42 0.34 -1.16 0.00 0.00 179.01 178.97 1ce8 s ASP 674 N -6.09 6.37 0.24 1.42 -1.08 0.35 -4.92 116.67 112.96 1ce8 s ASP 674 Ca 0.00 -0.28 0.09 0.00 -0.52 0.00 0.00 52.55 51.84 1ce8 s ASP 674 Cb 0.10 -2.40 0.77 0.00 -1.46 0.00 0.00 42.92 39.93 1ce8 s ASP 674 CO 0.61 -1.05 1.12 -2.11 0.52 0.00 0.00 175.17 174.26 1ce8 n ARG 675 N 6.99 -0.05 -0.06 4.34 0.00 -1.26 0.06 116.66 126.69 1ce8 n ARG 675 Ca 0.01 1.02 -0.16 0.00 -0.00 0.00 0.00 57.85 58.72 1ce8 n ARG 675 Cb 0.48 -1.73 -0.13 0.00 -0.00 0.00 0.00 32.46 31.07 1ce8 n ARG 675 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1ce8 h GLU 676 N 0.00 0.04 -0.35 2.89 5.08 -1.91 -3.06 114.58 117.27 1ce8 h GLU 676 Ca 0.53 -0.06 0.08 0.00 -1.00 0.00 0.00 59.36 58.90 1ce8 h GLU 676 Cb 1.28 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 30.47 1ce8 h GLU 676 CO -0.60 1.03 -0.28 0.00 -1.00 0.00 0.00 179.01 178.16 1ce8 h ARG 677 N -0.92 -0.23 -0.11 2.33 3.08 -0.97 -2.32 114.38 115.25 1ce8 h ARG 677 Ca -0.07 0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.01 1ce8 h ARG 677 Cb 1.13 0.05 -0.05 0.00 0.08 0.00 0.00 29.97 31.19 1ce8 h ARG 677 CO -0.01 -0.15 -0.38 0.35 -1.07 0.00 0.00 179.97 178.71 1ce8 h PHE 678 N -0.24 -1.13 -1.17 3.04 3.57 0.22 -0.77 116.94 120.46 1ce8 h PHE 678 Ca 0.17 0.04 0.33 0.00 3.53 0.00 0.00 57.97 62.04 1ce8 h PHE 678 Cb 0.50 0.51 -0.09 0.00 2.79 0.00 0.00 35.95 39.66 1ce8 h PHE 678 CO -0.48 -0.38 0.78 0.37 -2.23 0.00 0.00 178.31 176.38 1ce8 h GLN 679 N -0.40 0.21 -0.16 1.11 4.15 -1.38 0.19 115.11 118.83 1ce8 h GLN 679 Ca 0.02 -0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.40 1ce8 h GLN 679 Cb 0.47 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 1ce8 h GLN 679 CO -0.31 0.14 -0.01 0.45 -1.93 0.00 0.00 178.83 177.17 1ce8 h HIS 680 N 0.21 0.32 -0.22 3.99 3.86 -0.60 -0.95 115.15 121.76 1ce8 h HIS 680 Ca 0.65 -0.06 0.03 0.00 -1.16 0.00 0.00 60.37 59.83 1ce8 h HIS 680 Cb 2.01 -0.08 -0.03 0.00 1.06 0.00 0.00 27.41 30.37 1ce8 h HIS 680 CO -0.00 0.52 0.05 0.00 0.86 0.00 0.00 177.93 179.36 1ce8 h ALA 681 N 0.76 0.23 -0.32 2.45 0.00 -0.35 0.39 119.26 122.42 1ce8 h ALA 681 Ca 0.05 0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.07 1ce8 h ALA 681 Cb 0.40 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.17 1ce8 h ALA 681 CO 0.01 -0.38 -0.14 0.28 0.00 0.00 0.00 179.25 179.02 1ce8 h VAL 682 N 0.14 0.55 -0.14 0.00 2.07 -0.65 0.29 116.25 118.51 1ce8 h VAL 682 Ca 0.10 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.55 1ce8 h VAL 682 Cb 0.10 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1ce8 h VAL 682 CO -0.13 0.00 -0.23 -0.33 0.02 0.00 0.00 177.57 176.90 1ce8 h GLU 683 N -0.08 0.24 -0.49 1.57 5.08 -0.79 -0.45 114.58 119.66 1ce8 h GLU 683 Ca 0.16 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.38 1ce8 h GLU 683 Cb 0.33 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 1ce8 h GLU 683 CO -0.38 0.46 0.02 -0.09 -1.00 0.00 0.00 179.01 178.02 1ce8 h ARG 684 N 0.22 0.81 -0.00 2.33 2.43 0.24 -2.49 114.38 117.91 1ce8 h ARG 684 Ca 0.04 -0.21 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 1ce8 h ARG 684 Cb 0.53 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.99 1ce8 h ARG 684 CO 0.04 0.80 -0.16 1.28 -1.51 0.00 0.00 179.97 180.41 1ce8 n LEU 685 N -4.22 0.27 -3.53 3.80 4.77 0.75 -4.93 117.00 113.90 1ce8 n LEU 685 Ca 0.03 0.21 -0.20 0.00 -0.03 0.00 0.00 56.01 56.02 1ce8 n LEU 685 Cb 0.29 -0.33 0.08 0.00 -2.33 0.00 0.00 43.42 41.13 1ce8 n LEU 685 CO 0.41 0.06 0.12 0.29 -1.33 0.00 0.00 177.39 176.94 1ce8 n LYS 686 N -1.33 -6.68 -3.03 3.23 5.02 -0.25 -5.01 118.16 110.11 1ce8 n LYS 686 Ca 0.09 0.80 -0.20 0.00 -2.02 0.00 0.00 58.31 56.98 1ce8 n LYS 686 Cb 0.31 -5.76 0.07 0.00 -0.02 0.00 0.00 35.03 29.63 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 -6.68 3.04 -0.27 -0.35 1.43 -0.77 -5.03 118.68 110.04 1ce8 s LEU 687 Ca 0.18 -0.89 -0.02 0.00 -1.03 0.00 0.00 54.13 52.36 1ce8 s LEU 687 Cb -0.08 -1.51 0.03 0.00 0.03 0.00 0.00 46.19 44.66 1ce8 s LEU 687 CO 0.75 -1.42 -0.03 -0.75 0.23 0.00 0.00 176.35 175.13 1ce8 s LYS 688 N -4.71 2.76 0.34 1.70 2.20 -1.26 -4.78 119.74 115.98 1ce8 s LYS 688 Ca 0.63 -1.04 0.09 0.00 -0.36 0.00 0.00 55.97 55.29 1ce8 s LYS 688 Cb -0.05 -3.07 -0.05 0.00 -1.51 0.00 0.00 37.83 33.15 1ce8 s LYS 688 CO 0.40 -0.46 0.09 -1.14 -0.36 0.00 0.00 175.35 173.87 1ce8 s GLN 689 N 1.32 2.25 0.32 4.03 0.74 -1.26 0.19 119.66 127.25 1ce8 s GLN 689 Ca -0.01 -1.63 -0.15 0.00 0.05 0.00 0.00 55.36 53.62 1ce8 s GLN 689 Cb -0.17 -2.07 -0.09 0.00 1.10 0.00 0.00 33.01 31.78 1ce8 s GLN 689 CO -0.03 0.12 0.73 -2.14 -0.55 0.00 0.00 175.29 173.43 1ce8 s PRO 690 N -3.79 4.01 0.26 1.67 0.02 -1.26 -4.90 135.00 131.02 1ce8 s PRO 690 Ca 0.36 0.67 -0.31 0.00 0.02 0.00 0.00 61.00 61.74 1ce8 s PRO 690 Cb -0.01 -2.46 -0.12 0.00 0.02 0.00 0.00 34.50 31.93 1ce8 s PRO 690 CO 0.21 0.17 1.66 0.00 -0.33 0.00 0.00 177.00 178.71 1ce8 n ALA 691 N -0.31 2.75 -2.25 -1.55 0.00 -1.26 -4.75 120.51 113.13 1ce8 n ALA 691 Ca 0.03 0.38 -0.15 0.00 0.00 0.00 0.00 53.44 53.71 1ce8 n ALA 691 Cb 0.53 -2.50 -0.09 0.00 0.00 0.00 0.00 19.45 17.39 1ce8 n ALA 691 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ce8 s ASN 692 N 0.78 0.70 -0.25 0.00 2.20 -1.26 0.14 114.94 117.25 1ce8 s ASN 692 Ca 0.68 -1.52 -0.26 0.00 -0.94 0.00 0.00 52.86 50.82 1ce8 s ASN 692 Cb -0.49 0.45 0.13 0.00 -2.00 0.00 0.00 41.25 39.33 1ce8 s ASN 692 CO 0.42 -0.93 1.04 0.00 -2.94 0.00 0.00 177.10 174.70 1ce8 s ALA 693 N -3.89 -1.97 0.13 3.54 0.00 0.73 -4.99 121.76 115.31 1ce8 s ALA 693 Ca 0.39 1.78 -0.08 0.00 0.00 0.00 0.00 51.96 54.06 1ce8 s ALA 693 Cb 0.05 -1.25 -0.06 0.00 0.00 0.00 0.00 23.12 21.86 1ce8 s ALA 693 CO 0.18 -0.25 0.42 0.99 0.00 0.00 0.00 175.76 177.10 1ce8 s THR 694 N -0.17 5.09 -0.09 0.00 2.01 -1.26 -1.32 115.64 119.90 1ce8 s THR 694 Ca 0.02 0.31 -0.07 0.00 0.31 0.00 0.00 61.69 62.25 1ce8 s THR 694 Cb -0.04 -3.63 0.03 0.00 0.01 0.00 0.00 72.50 68.87 1ce8 s THR 694 CO -0.04 0.13 0.23 -0.69 -0.69 0.00 0.00 174.62 173.55 1ce8 s VAL 695 N -1.57 -0.01 -0.25 3.82 1.01 -0.71 -4.97 120.40 117.72 1ce8 s VAL 695 Ca 0.39 0.03 0.04 0.00 0.00 0.00 0.00 61.98 62.43 1ce8 s VAL 695 Cb -0.13 -0.33 -0.18 0.00 0.00 0.00 0.00 36.38 35.74 1ce8 s VAL 695 CO 0.21 0.01 -0.20 0.41 0.00 0.00 0.00 175.10 175.53 1ce8 n THR 696 N 3.22 1.48 -4.06 3.92 -1.04 -1.26 -2.72 114.28 113.82 1ce8 n THR 696 Ca -0.15 -0.60 -0.22 0.00 -2.04 0.00 0.00 64.05 61.04 1ce8 n THR 696 Cb 0.57 -1.32 -0.05 0.00 -1.82 0.00 0.00 70.33 67.72 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 -2.52 3.59 -0.80 2.41 0.00 -1.26 -4.92 121.76 118.27 1ce8 s ALA 697 Ca -0.32 -1.53 0.21 0.00 0.00 0.00 0.00 51.96 50.32 1ce8 s ALA 697 Cb 0.09 -1.17 0.86 0.00 0.00 0.00 0.00 23.12 22.89 1ce8 s ALA 697 CO 0.62 0.18 1.66 -0.89 0.00 0.00 0.00 175.76 177.33 1ce8 n ILE 698 N -1.19 0.74 0.00 0.00 -0.00 -1.26 -2.17 119.36 115.48 1ce8 n ILE 698 Ca -0.06 0.14 0.00 0.00 -0.00 0.00 0.00 62.75 62.83 1ce8 n ILE 698 Cb 0.59 -0.93 0.00 0.00 -0.00 0.00 0.00 39.64 39.30 1ce8 n ILE 698 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 1ce8 n GLU 699 N -1.84 1.55 0.33 0.38 -0.58 -1.26 -4.58 120.64 114.64 1ce8 n GLU 699 Ca 0.04 0.00 -0.17 0.00 -0.42 0.00 0.00 57.16 56.61 1ce8 n GLU 699 Cb 0.25 -0.97 -0.09 0.00 -0.57 0.00 0.00 31.44 30.06 1ce8 n GLU 699 CO 0.00 0.00 0.00 1.98 -0.48 0.00 0.00 177.13 178.63 1ce8 h MET 700 N 0.00 -0.79 -0.33 3.49 4.05 -1.93 -3.25 114.93 116.17 1ce8 h MET 700 Ca 0.00 0.05 0.04 0.00 -0.28 0.00 0.00 59.70 59.51 1ce8 h MET 700 Cb 0.34 0.18 -0.06 0.00 -0.80 0.00 0.00 31.60 31.25 1ce8 h MET 700 CO 0.00 -0.50 -0.40 0.00 0.23 0.00 0.00 176.91 176.24 1ce8 h ALA 701 N -0.50 -0.62 -1.71 0.39 0.00 -1.71 -1.53 119.26 113.58 1ce8 h ALA 701 Ca -0.08 0.01 0.50 0.00 0.00 0.00 0.00 54.91 55.33 1ce8 h ALA 701 Cb 0.65 1.04 -0.07 0.00 0.00 0.00 0.00 17.79 19.40 1ce8 h ALA 701 CO 0.14 -0.82 1.33 0.28 0.00 0.00 0.00 179.25 180.18 1ce8 n VAL 702 N -4.59 0.00 -0.12 0.00 0.31 -1.23 0.21 118.33 112.91 1ce8 n VAL 702 Ca -0.02 1.38 -0.26 0.00 -0.01 0.00 0.00 64.34 65.44 1ce8 n VAL 702 Cb 0.24 -2.34 -0.10 0.00 -0.91 0.00 0.00 33.84 30.72 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 -3.69 0.57 -0.34 5.55 4.07 -0.81 -3.37 120.64 122.63 1ce8 n GLU 703 Ca 0.38 0.40 0.05 0.00 -0.06 0.00 0.00 57.16 57.94 1ce8 n GLU 703 Cb 1.84 -1.60 0.21 0.00 -0.06 0.00 0.00 31.44 31.83 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 0.91 -0.48 5.31 1.63 0.09 0.93 116.57 123.96 1ce8 h LYS 704 Ca -0.52 -0.05 0.10 0.00 -0.85 0.00 0.00 60.65 59.32 1ce8 h LYS 704 Cb 1.45 -0.21 -0.09 0.00 -0.60 0.00 0.00 32.23 32.78 1ce8 h LYS 704 CO -0.32 0.60 -0.15 0.00 -3.45 0.00 0.00 179.45 176.14 1ce8 h ALA 705 N 1.50 0.27 -0.91 5.00 0.00 0.23 0.38 119.26 125.74 1ce8 h ALA 705 Ca 0.46 0.18 0.14 0.00 0.00 0.00 0.00 54.91 55.69 1ce8 h ALA 705 Cb 0.42 0.42 -0.07 0.00 0.00 0.00 0.00 17.79 18.55 1ce8 h ALA 705 CO -0.25 -0.47 0.58 -0.22 0.00 0.00 0.00 179.25 178.89 1ce8 h LYS 706 N -0.03 0.73 0.72 0.00 1.63 -0.85 0.38 116.57 119.15 1ce8 h LYS 706 Ca 0.23 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.95 1ce8 h LYS 706 Cb 0.39 -0.17 0.01 0.00 -0.60 0.00 0.00 32.23 31.86 1ce8 h LYS 706 CO -0.52 0.48 -0.35 0.93 -3.45 0.00 0.00 179.45 176.55 1ce8 h GLU 707 N 0.75 -0.93 -0.37 1.90 5.08 0.52 -3.33 114.58 118.20 1ce8 h GLU 707 Ca 0.45 0.06 0.07 0.00 -1.00 0.00 0.00 59.36 58.95 1ce8 h GLU 707 Cb 0.65 0.21 -0.07 0.00 0.50 0.00 0.00 28.75 30.04 1ce8 h GLU 707 CO -0.21 -0.62 -0.10 0.82 -1.00 0.00 0.00 179.01 177.89 1ce8 h ILE 708 N -1.21 0.61 0.00 3.13 2.04 -1.10 -3.49 117.51 117.49 1ce8 h ILE 708 Ca -0.10 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.76 1ce8 h ILE 708 Cb 0.74 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 37.44 1ce8 h ILE 708 CO 0.16 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.92 1ce8 n GLY 709 N -1.30 2.09 3.84 5.37 0.00 0.10 -4.87 105.19 110.43 1ce8 n GLY 709 Ca 0.01 -1.49 -0.31 0.00 0.00 0.00 0.00 46.02 44.23 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 -0.60 3.34 0.78 1.61 1.51 -1.26 -4.49 117.35 118.24 1ce8 s TYR 710 Ca 0.00 1.40 -0.11 0.00 -1.01 0.00 0.00 57.07 57.34 1ce8 s TYR 710 Cb 0.00 -2.83 0.07 0.00 -0.11 0.00 0.00 41.96 39.09 1ce8 s TYR 710 CO 0.00 -0.87 1.14 -1.25 -1.11 0.00 0.00 175.55 173.47 1ce8 s PRO 711 N -4.77 2.14 0.13 -1.71 0.05 -1.26 -4.92 135.00 124.66 1ce8 s PRO 711 Ca 0.58 0.12 0.08 0.00 0.05 0.00 0.00 61.00 61.83 1ce8 s PRO 711 Cb -0.12 -1.99 -0.04 0.00 0.05 0.00 0.00 34.50 32.40 1ce8 s PRO 711 CO 0.48 -1.46 -0.19 -0.51 0.05 0.00 0.00 177.00 175.36 1ce8 s LEU 712 N -5.50 2.37 -0.32 -3.56 1.02 0.51 -1.24 118.68 111.96 1ce8 s LEU 712 Ca 0.61 -0.78 -0.11 0.00 0.02 0.00 0.00 54.13 53.87 1ce8 s LEU 712 Cb -0.11 -0.85 -0.01 0.00 0.02 0.00 0.00 46.19 45.24 1ce8 s LEU 712 CO 0.49 0.01 0.18 -0.69 0.02 0.00 0.00 176.35 176.36 1ce8 s VAL 713 N -1.63 4.87 -0.43 -1.59 1.01 0.33 -0.08 120.40 122.88 1ce8 s VAL 713 Ca 0.11 -0.32 -0.05 0.00 0.00 0.00 0.00 61.98 61.71 1ce8 s VAL 713 Cb -0.08 -3.48 0.11 0.00 0.00 0.00 0.00 36.38 32.93 1ce8 s VAL 713 CO 0.05 0.05 0.25 -0.69 0.00 0.00 0.00 175.10 174.76 1ce8 s VAL 714 N 1.66 3.65 -0.13 2.92 1.01 0.81 -0.97 120.40 129.36 1ce8 s VAL 714 Ca 0.05 -1.89 -0.10 0.00 0.00 0.00 0.00 61.98 60.05 1ce8 s VAL 714 Cb -0.17 -3.43 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 1ce8 s VAL 714 CO 0.08 -0.68 0.20 -0.13 0.00 0.00 0.00 175.10 174.57 1ce8 s ARG 715 N 1.24 3.81 -0.13 2.72 0.52 -0.73 -1.63 118.95 124.75 1ce8 s ARG 715 Ca 0.06 -0.04 -0.13 0.00 -0.52 0.00 0.00 55.73 55.10 1ce8 s ARG 715 Cb -0.24 -3.29 -0.04 0.00 0.52 0.00 0.00 34.95 31.90 1ce8 s ARG 715 CO -0.02 0.57 -0.26 -0.35 0.02 0.00 0.00 175.30 175.26 1ce8 n PRO 716 N 2.57 0.39 -3.66 3.54 -0.05 -1.26 -0.52 135.00 136.01 1ce8 n PRO 716 Ca -0.17 0.16 -0.22 0.00 -0.05 0.00 0.00 63.50 63.21 1ce8 n PRO 716 Cb 0.53 -1.18 0.00 0.00 -0.05 0.00 0.00 33.50 32.80 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 -3.97 -2.73 -2.65 0.55 0.00 -1.26 -3.93 120.51 106.53 1ce8 n ALA 724 Ca -0.10 -0.16 -0.37 0.00 0.00 0.00 0.00 53.44 52.81 1ce8 n ALA 724 Cb 0.38 -0.99 -0.09 0.00 0.00 0.00 0.00 19.45 18.75 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 -4.43 4.08 0.32 0.00 0.00 -1.26 -5.04 119.30 112.96 1ce8 s MET 725 Ca 0.04 -0.14 0.10 0.00 0.00 0.00 0.00 55.69 55.69 1ce8 s MET 725 Cb -0.00 -3.56 -0.06 0.00 0.00 0.00 0.00 34.83 31.21 1ce8 s MET 725 CO 0.87 -0.02 -0.09 -2.00 0.00 0.00 0.00 175.02 173.79 1ce8 s GLU 726 N 1.27 1.90 -0.34 3.16 2.12 -0.65 -4.73 118.70 121.44 1ce8 s GLU 726 Ca 0.11 -1.78 -0.08 0.00 0.36 0.00 0.00 54.97 53.57 1ce8 s GLU 726 Cb -0.14 -1.83 0.02 0.00 0.26 0.00 0.00 34.13 32.44 1ce8 s GLU 726 CO 0.06 0.22 0.13 0.42 -0.54 0.00 0.00 175.26 175.56 1ce8 s ILE 727 N -2.53 4.14 -0.17 -3.70 1.01 -1.26 -0.13 121.20 118.56 1ce8 s ILE 727 Ca 0.32 -0.88 -0.09 0.00 0.00 0.00 0.00 60.65 60.00 1ce8 s ILE 727 Cb -0.01 -3.26 -0.05 0.00 0.01 0.00 0.00 42.46 39.15 1ce8 s ILE 727 CO 0.17 -0.11 0.14 -0.69 0.00 0.00 0.00 174.94 174.45 1ce8 s VAL 728 N 1.49 5.44 -0.05 2.92 1.01 0.88 -4.80 120.40 127.28 1ce8 s VAL 728 Ca 0.01 0.22 0.20 0.00 0.00 0.00 0.00 61.98 62.40 1ce8 s VAL 728 Cb -0.19 -3.45 -0.30 0.00 0.00 0.00 0.00 36.38 32.44 1ce8 s VAL 728 CO 0.04 0.50 0.44 -1.22 0.00 0.00 0.00 175.10 174.86 1ce8 n TYR 729 N 2.97 0.00 -3.65 5.22 4.02 -1.26 0.19 117.16 124.66 1ce8 n TYR 729 Ca -0.17 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.62 1ce8 n TYR 729 Cb 0.53 -0.43 -0.02 0.00 -0.02 0.00 0.00 39.34 39.40 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 -4.21 -0.41 0.21 7.72 1.47 -1.26 -4.68 116.67 115.52 1ce8 s ASP 730 Ca -0.07 -0.32 -0.16 0.00 1.18 0.00 0.00 52.55 53.18 1ce8 s ASP 730 Cb 0.13 0.66 0.22 0.00 -0.34 0.00 0.00 42.92 43.58 1ce8 s ASP 730 CO 0.81 -1.16 1.43 1.21 0.68 0.00 0.00 175.17 178.15 1ce8 n GLU 731 N -0.42 -0.22 -0.12 2.11 2.13 -1.26 0.73 120.64 123.59 1ce8 n GLU 731 Ca -0.10 1.42 -0.05 0.00 0.66 0.00 0.00 57.16 59.09 1ce8 n GLU 731 Cb 0.62 -2.11 0.03 0.00 0.27 0.00 0.00 31.44 30.25 1ce8 n GLU 731 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ce8 h ALA 732 N 1.26 0.46 -0.33 4.31 0.00 -2.00 -1.39 119.26 121.57 1ce8 h ALA 732 Ca 0.32 0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.36 1ce8 h ALA 732 Cb 0.55 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.31 1ce8 h ALA 732 CO -0.92 -0.27 -0.24 0.22 0.00 0.00 0.00 179.25 178.04 1ce8 h ASP 733 N 0.27 -0.80 -0.27 0.00 1.82 -0.09 -0.81 116.42 116.55 1ce8 h ASP 733 Ca 0.19 0.15 0.03 0.00 -0.39 0.00 0.00 57.03 57.01 1ce8 h ASP 733 Cb 0.19 0.39 -0.05 0.00 0.68 0.00 0.00 39.33 40.54 1ce8 h ASP 733 CO -0.21 -0.27 -0.31 0.25 -1.61 0.00 0.00 179.24 177.09 1ce8 h LEU 734 N -0.21 -1.06 -0.30 2.28 5.85 0.43 0.14 115.31 122.44 1ce8 h LEU 734 Ca 0.16 0.14 0.06 0.00 0.84 0.00 0.00 57.88 59.09 1ce8 h LEU 734 Cb 0.47 0.44 -0.08 0.00 0.37 0.00 0.00 40.66 41.85 1ce8 h LEU 734 CO -0.45 -0.21 -0.41 0.03 -0.34 0.00 0.00 178.44 177.06 1ce8 h ARG 735 N -0.19 -0.37 -0.91 1.25 3.08 -1.13 0.76 114.38 116.88 1ce8 h ARG 735 Ca 0.05 0.02 0.16 0.00 0.07 0.00 0.00 59.98 60.28 1ce8 h ARG 735 Cb 0.32 0.08 -0.16 0.00 0.08 0.00 0.00 29.97 30.29 1ce8 h ARG 735 CO -0.36 -0.24 -0.31 -0.09 -1.07 0.00 0.00 179.97 177.90 1ce8 h ARG 736 N -0.38 -0.02 0.74 0.04 2.43 -0.72 0.43 114.38 116.90 1ce8 h ARG 736 Ca 0.12 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.26 1ce8 h ARG 736 Cb 0.59 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1ce8 h ARG 736 CO -0.50 -0.01 -0.46 -0.92 -1.51 0.00 0.00 179.97 176.57 1ce8 h TYR 737 N -0.02 -1.21 -0.96 2.20 3.20 0.69 -2.88 116.97 117.99 1ce8 h TYR 737 Ca 0.37 -0.01 0.38 0.00 3.14 0.00 0.00 58.73 62.61 1ce8 h TYR 737 Cb 0.63 0.43 -0.15 0.00 1.54 0.00 0.00 36.73 39.18 1ce8 h TYR 737 CO -0.77 -0.68 0.55 1.19 -1.64 0.00 0.00 178.16 176.81 1ce8 n PHE 738 N -5.59 0.90 0.26 -3.82 3.72 0.13 -1.12 117.46 111.92 1ce8 n PHE 738 Ca -0.14 0.91 -0.13 0.00 -0.05 0.00 0.00 57.45 58.03 1ce8 n PHE 738 Cb 0.47 -1.32 -0.07 0.00 -0.94 0.00 0.00 39.48 37.62 1ce8 n PHE 738 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 1ce8 h GLN 739 N 0.00 -0.66 0.00 -1.08 4.15 -0.65 -3.01 115.11 113.86 1ce8 h GLN 739 Ca 0.75 0.04 0.00 0.00 0.77 0.00 0.00 58.65 60.21 1ce8 h GLN 739 Cb 2.10 0.15 0.00 0.00 0.21 0.00 0.00 27.48 29.94 1ce8 h GLN 739 CO -0.59 -0.36 0.00 1.79 -1.93 0.00 0.00 178.83 177.74 1ce8 h THR 740 N -1.05 0.00 0.00 2.39 1.35 -1.15 -3.52 112.91 110.93 1ce8 h THR 740 Ca -0.07 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 65.73 1ce8 h THR 740 Cb 0.60 0.78 0.00 0.00 -1.73 0.00 0.00 68.15 67.80 1ce8 h THR 740 CO 0.11 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.38 1ce8 n ALA 741 N -1.90 0.00 -2.99 6.62 0.00 -0.28 -5.12 120.51 116.84 1ce8 n ALA 741 Ca -0.02 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.46 1ce8 n ALA 741 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.54 1ce8 n ALA 741 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1ce8 s VAL 750 N 0.00 -0.25 0.31 0.00 1.01 -1.10 -5.10 120.40 115.27 1ce8 s VAL 750 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 61.98 61.71 1ce8 s VAL 750 Cb 0.00 -0.14 -0.09 0.00 0.00 0.00 0.00 36.38 36.15 1ce8 s VAL 750 CO 0.00 0.00 1.01 -0.76 0.00 0.00 0.00 175.10 175.35 1ce8 s LEU 751 N 2.51 4.43 -0.14 3.92 1.02 0.33 -1.73 118.68 129.02 1ce8 s LEU 751 Ca 0.22 2.03 -0.02 0.00 0.02 0.00 0.00 54.13 56.37 1ce8 s LEU 751 Cb 0.00 -3.85 0.05 0.00 0.02 0.00 0.00 46.19 42.41 1ce8 s LEU 751 CO -0.19 -0.12 0.03 -0.76 0.02 0.00 0.00 176.35 175.32 1ce8 s LEU 752 N -1.80 0.79 0.00 1.79 1.02 -0.43 -1.77 118.68 118.27 1ce8 s LEU 752 Ca 0.48 -0.46 0.06 0.00 0.02 0.00 0.00 54.13 54.22 1ce8 s LEU 752 Cb -0.25 -0.47 -0.02 0.00 0.02 0.00 0.00 46.19 45.48 1ce8 s LEU 752 CO 0.31 -0.27 -0.18 -1.81 0.02 0.00 0.00 176.35 174.43 1ce8 s ASP 753 N 1.95 2.08 0.13 2.29 1.11 -0.14 -0.19 116.67 123.91 1ce8 s ASP 753 Ca 0.02 -0.37 -0.31 0.00 0.18 0.00 0.00 52.55 52.07 1ce8 s ASP 753 Cb -0.15 -0.21 -0.10 0.00 1.07 0.00 0.00 42.92 43.54 1ce8 s ASP 753 CO -0.07 0.19 1.60 -2.28 1.18 0.00 0.00 175.17 175.79 1ce8 s HIS 754 N -0.52 2.84 -0.14 4.23 5.65 0.12 0.12 115.29 127.59 1ce8 s HIS 754 Ca 0.06 0.51 -0.26 0.00 0.25 0.00 0.00 55.06 55.62 1ce8 s HIS 754 Cb -0.07 -3.95 -0.02 0.00 -1.18 0.00 0.00 32.58 27.36 1ce8 s HIS 754 CO -0.00 -3.61 0.86 0.12 -0.65 0.00 0.00 174.74 171.46 1ce8 s PHE 755 N 1.65 3.47 -0.82 3.88 5.36 -0.38 -4.75 117.98 126.39 1ce8 s PHE 755 Ca 0.72 1.34 -0.21 0.00 -0.96 0.00 0.00 56.93 57.82 1ce8 s PHE 755 Cb -0.43 -3.03 0.09 0.00 -0.34 0.00 0.00 43.02 39.31 1ce8 s PHE 755 CO 0.32 -0.19 1.11 -0.51 -1.46 0.00 0.00 175.22 174.48 1ce8 s LEU 756 N 1.92 4.50 0.69 6.12 1.43 -1.26 -4.52 118.68 127.55 1ce8 s LEU 756 Ca 0.41 -1.46 -0.13 0.00 -1.03 0.00 0.00 54.13 51.91 1ce8 s LEU 756 Cb -0.17 -2.44 0.01 0.00 0.03 0.00 0.00 46.19 43.62 1ce8 s LEU 756 CO 0.15 -1.31 1.09 -0.62 0.23 0.00 0.00 176.35 175.89 1ce8 s ASP 757 N 3.83 5.04 -1.60 2.29 2.15 -1.26 -3.72 116.67 123.39 1ce8 s ASP 757 Ca 0.30 1.89 -0.16 0.00 0.43 0.00 0.00 52.55 55.01 1ce8 s ASP 757 Cb -0.09 -2.54 0.13 0.00 -0.30 0.00 0.00 42.92 40.12 1ce8 s ASP 757 CO -0.00 -1.68 0.79 0.47 -0.17 0.00 0.00 175.17 174.58 1ce8 n ASP 758 N -2.75 -3.72 -4.63 -0.34 8.00 -1.26 -4.95 116.55 106.90 1ce8 n ASP 758 Ca 0.10 -0.87 -0.30 0.00 0.71 0.00 0.00 54.79 54.43 1ce8 n ASP 758 Cb 0.52 -3.03 -0.09 0.00 -0.02 0.00 0.00 41.12 38.51 1ce8 n ASP 758 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ce8 s ALA 759 N -3.22 3.12 -0.27 2.24 0.00 -1.24 -4.83 121.76 117.55 1ce8 s ALA 759 Ca 0.68 -1.16 -0.13 0.00 0.00 0.00 0.00 51.96 51.35 1ce8 s ALA 759 Cb -0.37 -1.06 -0.04 0.00 0.00 0.00 0.00 23.12 21.66 1ce8 s ALA 759 CO 0.84 0.67 0.30 0.08 0.00 0.00 0.00 175.76 177.65 1ce8 s VAL 760 N -1.24 5.23 0.09 0.00 1.01 -0.91 -1.78 120.40 122.81 1ce8 s VAL 760 Ca 0.23 0.41 -0.24 0.00 0.00 0.00 0.00 61.98 62.38 1ce8 s VAL 760 Cb -0.11 -3.63 -0.07 0.00 0.00 0.00 0.00 36.38 32.57 1ce8 s VAL 760 CO 0.15 0.20 0.72 -0.70 0.00 0.00 0.00 175.10 175.47 1ce8 s GLU 761 N 1.89 4.46 0.03 2.72 2.12 -1.26 -0.41 118.70 128.24 1ce8 s GLU 761 Ca 0.12 1.01 0.03 0.00 0.36 0.00 0.00 54.97 56.49 1ce8 s GLU 761 Cb -0.16 -3.30 -0.02 0.00 0.26 0.00 0.00 34.13 30.91 1ce8 s GLU 761 CO 0.10 0.46 -0.10 0.08 -0.54 0.00 0.00 175.26 175.26 1ce8 s VAL 762 N -0.66 0.75 -0.07 3.70 1.01 -0.05 -0.71 120.40 124.36 1ce8 s VAL 762 Ca 0.35 -0.86 0.05 0.00 0.00 0.00 0.00 61.98 61.52 1ce8 s VAL 762 Cb -0.21 -0.72 -0.00 0.00 0.00 0.00 0.00 36.38 35.45 1ce8 s VAL 762 CO 0.23 -0.11 -0.23 -1.81 0.00 0.00 0.00 175.10 173.18 1ce8 s ASP 763 N -1.08 2.87 -0.10 3.32 1.01 -0.62 -0.49 116.67 121.59 1ce8 s ASP 763 Ca -0.03 -0.50 0.01 0.00 0.71 0.00 0.00 52.55 52.75 1ce8 s ASP 763 Cb -0.07 -1.05 0.02 0.00 1.01 0.00 0.00 42.92 42.83 1ce8 s ASP 763 CO 0.01 0.18 -0.11 -0.69 0.21 0.00 0.00 175.17 174.77 1ce8 s VAL 764 N 0.13 1.18 -0.07 -1.27 1.01 0.57 -0.63 120.40 121.32 1ce8 s VAL 764 Ca -0.11 -0.44 -0.03 0.00 0.00 0.00 0.00 61.98 61.40 1ce8 s VAL 764 Cb -0.15 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 1ce8 s VAL 764 CO 0.06 0.38 0.06 -1.81 0.00 0.00 0.00 175.10 173.79 1ce8 s ASP 765 N 1.21 5.68 0.22 3.32 1.01 0.31 -0.47 116.67 127.95 1ce8 s ASP 765 Ca -0.04 0.24 -0.14 0.00 0.71 0.00 0.00 52.55 53.32 1ce8 s ASP 765 Cb -0.14 -1.68 0.01 0.00 1.01 0.00 0.00 42.92 42.11 1ce8 s ASP 765 CO -0.03 0.36 0.48 0.00 0.21 0.00 0.00 175.17 176.19 1ce8 s ALA 766 N -1.00 -0.51 -0.03 5.23 0.00 -0.40 0.80 121.76 125.85 1ce8 s ALA 766 Ca 0.16 -0.61 0.03 0.00 0.00 0.00 0.00 51.96 51.54 1ce8 s ALA 766 Cb -0.12 0.94 0.00 0.00 0.00 0.00 0.00 23.12 23.94 1ce8 s ALA 766 CO 0.06 -0.81 -0.10 0.42 0.00 0.00 0.00 175.76 175.33 1ce8 s ILE 767 N -3.95 0.83 -0.07 0.00 1.01 0.13 -1.15 121.20 118.00 1ce8 s ILE 767 Ca 0.16 -0.39 0.03 0.00 0.00 0.00 0.00 60.65 60.44 1ce8 s ILE 767 Cb -0.00 -0.74 0.01 0.00 0.01 0.00 0.00 42.46 41.74 1ce8 s ILE 767 CO 0.03 0.26 -0.15 0.00 0.00 0.00 0.00 174.94 175.08 1ce8 n ASP 769 N 3.77 3.18 0.00 0.00 5.75 -0.58 -1.44 116.55 127.23 1ce8 n ASP 769 Ca -0.22 -1.92 0.00 0.00 -0.01 0.00 0.00 54.79 52.64 1ce8 n ASP 769 Cb 0.52 -0.25 0.00 0.00 -1.03 0.00 0.00 41.12 40.36 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 1.11 2.21 0.02 6.12 0.00 -1.26 -4.72 105.19 108.67 1ce8 n GLY 770 Ca 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.18 1ce8 n GLY 770 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ce8 n GLU 771 N -2.00 1.55 -3.70 1.61 2.13 -1.26 -5.05 120.64 113.92 1ce8 n GLU 771 Ca 0.00 -0.04 -0.10 0.00 0.66 0.00 0.00 57.16 57.68 1ce8 n GLU 771 Cb 0.00 -1.22 -0.04 0.00 0.27 0.00 0.00 31.44 30.45 1ce8 n GLU 771 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ce8 s MET 772 N -2.40 1.34 -0.14 5.31 0.23 -1.26 -5.16 119.30 117.22 1ce8 s MET 772 Ca -0.04 -0.82 0.02 0.00 -1.03 0.00 0.00 55.69 53.83 1ce8 s MET 772 Cb 0.04 0.52 0.01 0.00 -1.53 0.00 0.00 34.83 33.87 1ce8 s MET 772 CO 0.36 -0.57 -0.21 0.08 -2.03 0.00 0.00 175.02 172.65 1ce8 s VAL 773 N -3.86 2.00 -0.26 5.16 1.01 -1.26 -1.52 120.40 121.67 1ce8 s VAL 773 Ca 0.08 -0.94 -0.10 0.00 0.00 0.00 0.00 61.98 61.02 1ce8 s VAL 773 Cb -0.01 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 1ce8 s VAL 773 CO -0.05 0.54 0.15 -0.22 0.00 0.00 0.00 175.10 175.52 1ce8 s LEU 774 N 0.82 3.90 -0.29 3.92 2.96 0.65 -4.92 118.68 125.72 1ce8 s LEU 774 Ca -0.07 -0.03 -0.27 0.00 -0.22 0.00 0.00 54.13 53.54 1ce8 s LEU 774 Cb -0.16 -2.06 0.01 0.00 0.50 0.00 0.00 46.19 44.48 1ce8 s LEU 774 CO -0.02 -0.01 0.98 -0.63 -1.32 0.00 0.00 176.35 175.36 1ce8 s ILE 775 N 1.51 4.64 -0.13 6.68 -1.09 -1.26 0.22 121.20 131.77 1ce8 s ILE 775 Ca 0.07 1.68 -0.24 0.00 -2.23 0.00 0.00 60.65 59.93 1ce8 s ILE 775 Cb -0.15 -4.31 -0.26 0.00 -1.58 0.00 0.00 42.46 36.16 1ce8 s ILE 775 CO 0.07 -0.32 0.65 1.23 -1.23 0.00 0.00 174.94 175.34 1ce8 h GLY 776 N 9.72 0.11 -4.71 6.18 0.00 0.05 -3.40 103.07 111.03 1ce8 h GLY 776 Ca -0.21 -0.29 0.15 0.00 0.00 0.00 0.00 47.33 46.98 1ce8 h GLY 776 CO 0.97 0.26 0.73 -0.32 0.00 0.00 0.00 176.54 178.18 1ce8 s GLY 777 N -4.51 -0.09 -0.24 4.60 0.00 -0.52 -4.69 107.32 101.86 1ce8 s GLY 777 Ca -0.20 2.43 0.02 0.00 0.00 0.00 0.00 44.72 46.97 1ce8 s GLY 777 CO 0.71 1.10 -0.11 -0.42 0.00 0.00 0.00 173.10 174.38 1ce8 s ILE 778 N -1.02 2.05 -0.14 0.90 1.01 -1.26 -0.53 121.20 122.21 1ce8 s ILE 778 Ca 0.03 -1.47 -0.03 0.00 0.00 0.00 0.00 60.65 59.18 1ce8 s ILE 778 Cb -0.01 -2.14 -0.03 0.00 0.01 0.00 0.00 42.46 40.29 1ce8 s ILE 778 CO -0.03 0.04 -0.05 -0.04 0.00 0.00 0.00 174.94 174.86 1ce8 s MET 779 N 1.17 3.51 -0.26 2.79 -1.94 0.20 -3.96 119.30 120.81 1ce8 s MET 779 Ca -0.07 -0.53 -0.09 0.00 -1.71 0.00 0.00 55.69 53.29 1ce8 s MET 779 Cb -0.19 -2.85 -0.04 0.00 2.01 0.00 0.00 34.83 33.76 1ce8 s MET 779 CO -0.06 0.32 0.14 -2.00 -0.01 0.00 0.00 175.02 173.40 1ce8 s GLU 780 N 0.15 3.87 0.53 2.03 2.12 -0.39 -1.59 118.70 125.42 1ce8 s GLU 780 Ca -0.02 -0.37 -0.19 0.00 0.36 0.00 0.00 54.97 54.76 1ce8 s GLU 780 Cb -0.14 -3.51 -0.06 0.00 0.26 0.00 0.00 34.13 30.68 1ce8 s GLU 780 CO 0.03 -0.13 1.06 -1.01 -0.54 0.00 0.00 175.26 174.68 1ce8 s HIS 781 N 1.55 2.91 -0.02 5.30 3.76 0.11 -1.71 115.29 127.20 1ce8 s HIS 781 Ca 0.07 1.55 -0.01 0.00 -0.15 0.00 0.00 55.06 56.52 1ce8 s HIS 781 Cb -0.15 -3.10 -0.00 0.00 1.11 0.00 0.00 32.58 30.43 1ce8 s HIS 781 CO 0.07 -1.10 0.11 0.82 -0.85 0.00 0.00 174.74 173.80 1ce8 h ILE 782 N 1.11 0.00 -3.81 0.60 5.03 -1.52 -3.43 117.51 115.50 1ce8 h ILE 782 Ca -0.49 -0.18 -0.56 0.00 -0.12 0.00 0.00 64.86 63.51 1ce8 h ILE 782 Cb 1.23 0.00 0.14 0.00 -3.03 0.00 0.00 36.82 35.16 1ce8 h ILE 782 CO 0.58 0.00 0.48 -0.62 -0.68 0.00 0.00 178.15 177.91 1ce8 n GLU 783 N -2.58 1.57 -1.96 2.37 4.71 -1.26 -4.64 120.64 118.85 1ce8 n GLU 783 Ca -0.00 0.58 -0.29 0.00 -0.01 0.00 0.00 57.16 57.44 1ce8 n GLU 783 Cb 0.01 -2.44 0.12 0.00 -1.01 0.00 0.00 31.44 28.12 1ce8 n GLU 783 CO 0.00 0.00 0.00 1.14 0.09 0.00 0.00 177.13 178.36 1ce8 s GLN 784 N -2.70 1.56 0.24 3.49 0.00 -1.26 -4.49 119.66 116.50 1ce8 s GLN 784 Ca 0.70 -0.13 -0.31 0.00 -0.00 0.00 0.00 55.36 55.62 1ce8 s GLN 784 Cb -0.44 -1.95 -0.13 0.00 0.00 0.00 0.00 33.01 30.48 1ce8 s GLN 784 CO 0.51 -1.82 1.41 0.00 0.00 0.00 0.00 175.29 175.39 1ce8 n ALA 785 N -3.40 1.17 0.00 2.60 0.00 -0.73 -1.59 120.51 118.55 1ce8 n ALA 785 Ca 0.11 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.95 1ce8 n ALA 785 Cb 0.60 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.77 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 2.12 1.90 3.23 0.00 0.00 -1.26 -4.83 105.19 106.35 1ce8 n GLY 786 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.16 2.98 0.13 1.61 1.01 -0.62 -1.85 120.40 121.49 1ce8 s VAL 787 Ca 0.00 -0.84 -0.35 0.00 0.00 0.00 0.00 61.98 60.80 1ce8 s VAL 787 Cb 0.00 -2.44 -0.16 0.00 0.00 0.00 0.00 36.38 33.78 1ce8 s VAL 787 CO 0.00 0.30 1.24 1.57 0.00 0.00 0.00 175.10 178.21 1ce8 n HIS 788 N 4.71 1.39 -0.36 5.22 -0.00 0.89 -4.74 115.22 122.33 1ce8 n HIS 788 Ca -0.17 0.66 0.04 0.00 0.46 0.00 0.00 57.72 58.71 1ce8 n HIS 788 Cb 0.49 -2.30 0.12 0.00 -0.12 0.00 0.00 29.99 28.17 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 3.89 -1.03 0.35 0.26 4.64 -1.90 0.33 113.55 120.09 1ce8 h SER 789 Ca -0.45 0.30 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1ce8 h SER 789 Cb 1.34 0.64 0.00 0.00 -0.31 0.00 0.00 62.40 64.07 1ce8 h SER 789 CO 0.73 -0.32 0.00 0.61 -0.87 0.00 0.00 176.83 176.99 1ce8 n GLY 790 N -1.59 -1.06 0.28 -0.77 0.00 -1.26 -1.43 105.19 99.36 1ce8 n GLY 790 Ca 0.14 0.14 0.03 0.00 0.00 0.00 0.00 46.02 46.34 1ce8 n GLY 790 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ce8 n ASP 791 N -2.24 1.95 -4.90 1.61 8.00 0.10 -4.69 116.55 116.39 1ce8 n ASP 791 Ca 0.00 -1.60 -0.32 0.00 0.71 0.00 0.00 54.79 53.59 1ce8 n ASP 791 Cb 0.13 -0.06 -0.05 0.00 -0.02 0.00 0.00 41.12 41.12 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 -0.73 6.46 0.53 -2.24 0.01 -0.51 -4.81 113.70 112.40 1ce8 s SER 792 Ca 0.09 0.50 -0.13 0.00 1.31 0.00 0.00 55.95 57.73 1ce8 s SER 792 Cb 0.06 -2.06 -0.06 0.00 0.21 0.00 0.00 66.02 64.17 1ce8 s SER 792 CO 0.08 0.10 0.95 0.00 0.41 0.00 0.00 173.24 174.78 1ce8 s ALA 793 N -1.58 3.15 0.13 1.44 0.00 -1.26 -4.70 121.76 118.94 1ce8 s ALA 793 Ca 0.38 -0.03 -0.14 0.00 0.00 0.00 0.00 51.96 52.17 1ce8 s ALA 793 Cb -0.12 -2.99 0.02 0.00 0.00 0.00 0.00 23.12 20.02 1ce8 s ALA 793 CO 0.25 -0.36 0.36 0.00 0.00 0.00 0.00 175.76 176.00 1ce8 s SER 795 N -2.84 2.02 -0.11 0.00 0.15 -0.69 0.34 113.70 112.57 1ce8 s SER 795 Ca 0.05 -0.53 -0.03 0.00 0.70 0.00 0.00 55.95 56.14 1ce8 s SER 795 Cb 0.02 -0.13 0.05 0.00 -1.71 0.00 0.00 66.02 64.25 1ce8 s SER 795 CO -0.10 0.06 0.11 -0.22 1.20 0.00 0.00 173.24 174.29 1ce8 s LEU 796 N -1.35 0.11 0.98 3.45 0.20 0.61 -1.26 118.68 121.41 1ce8 s LEU 796 Ca 0.03 -0.10 -0.13 0.00 0.69 0.00 0.00 54.13 54.62 1ce8 s LEU 796 Cb -0.09 -0.00 0.18 0.00 -0.43 0.00 0.00 46.19 45.85 1ce8 s LEU 796 CO 0.02 -0.29 1.13 -2.16 -0.29 0.00 0.00 176.35 174.77 1ce8 s PRO 797 N 2.21 0.60 0.30 0.98 0.04 -1.26 -0.40 135.00 137.47 1ce8 s PRO 797 Ca 0.04 0.26 -0.29 0.00 0.04 0.00 0.00 61.00 61.04 1ce8 s PRO 797 Cb -0.14 -1.78 -0.12 0.00 0.04 0.00 0.00 34.50 32.50 1ce8 s PRO 797 CO -0.07 -2.56 1.41 0.00 0.04 0.00 0.00 177.00 175.83 1ce8 n ALA 798 N -4.01 1.62 0.89 8.56 0.00 -1.25 -4.81 120.51 121.51 1ce8 n ALA 798 Ca 0.07 0.38 0.09 0.00 0.00 0.00 0.00 53.44 53.98 1ce8 n ALA 798 Cb 0.59 -2.32 -0.08 0.00 0.00 0.00 0.00 19.45 17.63 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 1.23 0.00 0.00 0.00 4.11 -1.26 -4.61 117.16 116.63 1ce8 n TYR 799 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.97 1ce8 n TYR 799 Cb 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.69 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 -1.10 0.00 -2.09 -3.48 -2.24 -1.26 -5.07 114.28 99.05 1ce8 n THR 800 Ca 0.05 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.41 1ce8 n THR 800 Cb 0.32 0.12 -0.03 0.00 -2.10 0.00 0.00 70.33 68.65 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 -1.29 4.39 0.71 3.22 1.43 -1.26 -4.98 118.68 120.89 1ce8 s LEU 801 Ca 0.00 2.55 -0.14 0.00 -1.03 0.00 0.00 54.13 55.51 1ce8 s LEU 801 Cb 0.00 -3.61 0.03 0.00 0.03 0.00 0.00 46.19 42.63 1ce8 s LEU 801 CO 0.00 -0.65 1.13 -0.94 0.23 0.00 0.00 176.35 176.12 1ce8 s SER 802 N 0.46 4.70 0.14 2.29 1.04 -1.26 -4.87 113.70 116.21 1ce8 s SER 802 Ca 0.60 2.05 -0.17 0.00 0.48 0.00 0.00 55.95 58.90 1ce8 s SER 802 Cb -0.40 -2.55 -0.01 0.00 0.10 0.00 0.00 66.02 63.16 1ce8 s SER 802 CO 0.40 -1.91 1.80 -0.61 0.98 0.00 0.00 173.24 173.90 1ce8 h GLN 803 N -0.34 0.45 -0.57 4.02 5.75 -1.99 -1.53 115.11 120.90 1ce8 h GLN 803 Ca -0.46 -0.03 0.10 0.00 -0.15 0.00 0.00 58.65 58.11 1ce8 h GLN 803 Cb 1.25 -0.10 -0.08 0.00 1.07 0.00 0.00 27.48 29.63 1ce8 h GLN 803 CO 0.52 0.30 0.15 1.49 -2.65 0.00 0.00 178.83 178.64 1ce8 h GLU 804 N 0.46 0.29 -0.67 1.69 4.81 -2.00 0.13 114.58 119.29 1ce8 h GLU 804 Ca 0.13 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.26 1ce8 h GLU 804 Cb -0.05 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.23 1ce8 h GLU 804 CO -0.03 0.19 0.11 0.82 -0.73 0.00 0.00 179.01 179.37 1ce8 h ILE 805 N 0.30 1.26 -0.67 2.32 1.08 -1.82 -2.91 117.51 117.08 1ce8 h ILE 805 Ca 0.29 -1.05 -0.06 0.00 -0.39 0.00 0.00 64.86 63.66 1ce8 h ILE 805 Cb 0.40 0.63 -0.03 0.00 -3.07 0.00 0.00 36.82 34.75 1ce8 h ILE 805 CO -0.35 0.39 0.20 1.56 -0.69 0.00 0.00 178.15 179.26 1ce8 h GLN 806 N 1.04 1.04 0.00 2.37 4.20 -0.37 -2.57 115.11 120.82 1ce8 h GLN 806 Ca 0.20 -0.23 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 1ce8 h GLN 806 Cb 0.45 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.08 1ce8 h GLN 806 CO 0.01 0.91 -0.11 -0.44 -0.67 0.00 0.00 178.83 178.54 1ce8 h ASP 807 N 0.97 0.00 -0.09 1.46 3.32 -0.66 0.27 116.42 121.69 1ce8 h ASP 807 Ca 0.21 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.25 1ce8 h ASP 807 Cb 0.32 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.86 1ce8 h ASP 807 CO -0.00 0.11 -0.01 0.58 -1.72 0.00 0.00 179.24 178.20 1ce8 h VAL 808 N 0.00 1.26 -0.63 -1.35 2.07 -1.27 0.20 116.25 116.54 1ce8 h VAL 808 Ca -0.00 -0.84 -0.03 0.00 0.82 0.00 0.00 66.70 66.65 1ce8 h VAL 808 Cb 0.23 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 31.61 1ce8 h VAL 808 CO 0.01 0.24 0.28 0.24 0.02 0.00 0.00 177.57 178.36 1ce8 h MET 809 N -0.12 0.90 -0.62 1.57 2.86 -1.14 0.16 114.93 118.54 1ce8 h MET 809 Ca 0.03 -0.13 0.02 0.00 -2.06 0.00 0.00 59.70 57.56 1ce8 h MET 809 Cb 0.37 -0.16 -0.04 0.00 0.06 0.00 0.00 31.60 31.83 1ce8 h MET 809 CO 0.01 0.71 0.39 0.00 1.06 0.00 0.00 176.91 179.08 1ce8 h ARG 810 N 0.89 0.75 -0.91 1.72 3.08 -0.09 -0.96 114.38 118.86 1ce8 h ARG 810 Ca 0.22 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.21 1ce8 h ARG 810 Cb 0.13 -0.17 -0.04 0.00 0.08 0.00 0.00 29.97 29.97 1ce8 h ARG 810 CO -0.02 0.49 0.51 1.96 -1.07 0.00 0.00 179.97 181.84 1ce8 h GLN 811 N 0.77 1.26 -0.31 0.04 4.20 0.21 -2.66 115.11 118.62 1ce8 h GLN 811 Ca 0.25 -0.14 -0.13 0.00 0.06 0.00 0.00 58.65 58.68 1ce8 h GLN 811 Cb -0.00 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.52 1ce8 h GLN 811 CO -0.09 0.91 -0.34 1.96 -0.67 0.00 0.00 178.83 180.59 1ce8 h GLN 812 N 1.27 0.69 -0.46 1.46 4.20 -0.26 -2.54 115.11 119.46 1ce8 h GLN 812 Ca 0.32 -0.33 -0.04 0.00 0.06 0.00 0.00 58.65 58.67 1ce8 h GLN 812 Cb 0.01 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 1ce8 h GLN 812 CO -0.05 0.93 0.15 0.28 -0.67 0.00 0.00 178.83 179.47 1ce8 h VAL 813 N 0.58 1.22 -0.28 -0.54 2.07 -1.09 -0.49 116.25 117.72 1ce8 h VAL 813 Ca 0.06 -0.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.84 1ce8 h VAL 813 Cb 0.86 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 1ce8 h VAL 813 CO 0.07 0.27 0.16 -0.61 0.02 0.00 0.00 177.57 177.48 1ce8 h GLN 814 N 0.61 0.38 -0.50 1.57 4.15 -1.40 0.59 115.11 120.51 1ce8 h GLN 814 Ca 0.15 -0.04 0.04 0.00 0.77 0.00 0.00 58.65 59.57 1ce8 h GLN 814 Cb 0.26 -0.08 -0.04 0.00 0.21 0.00 0.00 27.48 27.83 1ce8 h GLN 814 CO -0.01 0.31 0.27 0.87 -1.93 0.00 0.00 178.83 178.35 1ce8 h LYS 815 N 0.34 0.52 -0.13 1.69 6.56 -1.21 -1.82 116.57 122.52 1ce8 h LYS 815 Ca 0.10 -0.03 -0.01 0.00 -1.06 0.00 0.00 60.65 59.64 1ce8 h LYS 815 Cb 0.04 -0.12 -0.01 0.00 -0.57 0.00 0.00 32.23 31.57 1ce8 h LYS 815 CO -0.02 0.34 0.03 -0.07 -2.06 0.00 0.00 179.45 177.67 1ce8 h LEU 816 N 0.53 0.20 0.09 2.94 3.38 -0.86 -1.00 115.31 120.58 1ce8 h LEU 816 Ca 0.21 -0.23 0.02 0.00 0.09 0.00 0.00 57.88 57.97 1ce8 h LEU 816 Cb 0.09 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 1ce8 h LEU 816 CO -0.13 0.38 -0.48 0.00 0.09 0.00 0.00 178.44 178.30 1ce8 h ALA 817 N 0.82 -0.85 -0.57 1.53 0.00 -0.67 0.97 119.26 120.49 1ce8 h ALA 817 Ca 0.04 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1ce8 h ALA 817 Cb 0.26 0.81 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 1ce8 h ALA 817 CO 0.00 -1.05 0.36 0.74 0.00 0.00 0.00 179.25 179.30 1ce8 h PHE 818 N -0.69 0.68 0.29 0.00 0.04 -1.36 -1.25 116.94 114.66 1ce8 h PHE 818 Ca 0.01 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.80 1ce8 h PHE 818 Cb 0.72 -0.23 -0.02 0.00 2.20 0.00 0.00 35.95 38.62 1ce8 h PHE 818 CO -0.42 0.41 -0.26 1.49 -0.60 0.00 0.00 178.31 178.93 1ce8 h GLU 819 N 0.73 -0.55 0.00 1.51 4.57 -0.20 -2.28 114.58 118.36 1ce8 h GLU 819 Ca 0.22 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.43 1ce8 h GLU 819 Cb -0.04 0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.67 1ce8 h GLU 819 CO -0.07 -0.37 0.00 1.28 -1.18 0.00 0.00 179.01 178.68 1ce8 n LEU 820 N -5.38 0.00 -2.47 1.64 4.77 0.33 -4.91 117.00 110.97 1ce8 n LEU 820 Ca -0.09 0.22 -0.13 0.00 -0.03 0.00 0.00 56.01 55.99 1ce8 n LEU 820 Cb 0.29 -0.22 0.05 0.00 -2.33 0.00 0.00 43.42 41.21 1ce8 n LEU 820 CO 0.30 -0.07 0.11 0.00 -1.33 0.00 0.00 177.39 176.40 1ce8 n GLN 821 N -1.22 -4.52 -2.25 3.23 1.13 -0.53 -4.73 117.38 108.49 1ce8 n GLN 821 Ca 0.11 0.52 -0.41 0.00 -1.94 0.00 0.00 57.00 55.28 1ce8 n GLN 821 Cb 0.15 -4.60 -0.03 0.00 0.11 0.00 0.00 30.24 25.86 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 -3.21 3.27 -0.38 5.09 1.01 -0.83 -4.62 120.40 120.73 1ce8 s VAL 822 Ca 0.17 1.05 0.01 0.00 0.00 0.00 0.00 61.98 63.21 1ce8 s VAL 822 Cb -0.07 -3.67 0.14 0.00 0.00 0.00 0.00 36.38 32.77 1ce8 s VAL 822 CO 0.45 0.16 0.21 -0.13 0.00 0.00 0.00 175.10 175.80 1ce8 s ARG 823 N -0.17 0.82 0.00 2.72 1.81 -1.24 -4.10 118.95 118.79 1ce8 s ARG 823 Ca 0.56 -1.55 0.00 0.00 -1.72 0.00 0.00 55.73 53.01 1ce8 s ARG 823 Cb -0.36 -1.71 0.00 0.00 -0.45 0.00 0.00 34.95 32.43 1ce8 s ARG 823 CO 0.38 -1.18 0.00 0.41 -0.68 0.00 0.00 175.30 174.23 1ce8 n GLY 824 N 3.92 0.40 3.80 -3.53 0.00 -0.52 -1.71 105.19 107.53 1ce8 n GLY 824 Ca 0.10 -1.97 -0.32 0.00 0.00 0.00 0.00 46.02 43.83 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 3.34 0.14 0.99 1.43 -1.26 -2.22 118.68 121.10 1ce8 s LEU 825 Ca 0.00 1.80 -0.24 0.00 -1.03 0.00 0.00 54.13 54.67 1ce8 s LEU 825 Cb 0.00 -4.53 0.07 0.00 0.03 0.00 0.00 46.19 41.76 1ce8 s LEU 825 CO 0.00 -1.42 0.68 0.00 0.23 0.00 0.00 176.35 175.84 1ce8 s MET 826 N -4.40 1.24 -0.11 1.70 0.23 -0.30 -3.03 119.30 114.63 1ce8 s MET 826 Ca 0.63 -0.49 -0.09 0.00 -1.03 0.00 0.00 55.69 54.70 1ce8 s MET 826 Cb -0.16 0.55 0.03 0.00 -1.53 0.00 0.00 34.83 33.71 1ce8 s MET 826 CO 0.44 -0.55 0.28 1.21 -2.03 0.00 0.00 175.02 174.37 1ce8 s ASN 827 N -2.72 -0.29 -0.02 -1.18 3.84 0.15 -1.28 114.94 113.44 1ce8 s ASN 827 Ca 0.03 0.56 0.05 0.00 0.21 0.00 0.00 52.86 53.71 1ce8 s ASN 827 Cb -0.01 0.55 -0.01 0.00 -0.55 0.00 0.00 41.25 41.22 1ce8 s ASN 827 CO -0.10 -0.11 -0.16 -0.69 -2.79 0.00 0.00 177.10 173.25 1ce8 s VAL 828 N 0.34 1.29 -0.15 -5.21 1.01 0.38 -0.44 120.40 117.62 1ce8 s VAL 828 Ca -0.02 -0.69 -0.00 0.00 0.00 0.00 0.00 61.98 61.27 1ce8 s VAL 828 Cb -0.03 -1.08 -0.01 0.00 0.00 0.00 0.00 36.38 35.26 1ce8 s VAL 828 CO -0.01 0.37 -0.13 -1.10 0.00 0.00 0.00 175.10 174.22 1ce8 s GLN 829 N -0.32 3.31 0.30 2.72 -0.21 -0.66 -0.32 119.66 124.47 1ce8 s GLN 829 Ca 0.05 -0.71 0.09 0.00 0.02 0.00 0.00 55.36 54.81 1ce8 s GLN 829 Cb -0.07 -2.65 -0.06 0.00 1.00 0.00 0.00 33.01 31.23 1ce8 s GLN 829 CO -0.00 0.10 -0.11 -0.06 -2.12 0.00 0.00 175.29 173.09 1ce8 s PHE 830 N 0.64 2.17 -0.07 0.91 0.08 0.36 -0.65 117.98 121.42 1ce8 s PHE 830 Ca -0.07 -0.53 0.02 0.00 0.12 0.00 0.00 56.93 56.47 1ce8 s PHE 830 Cb -0.16 -1.16 0.01 0.00 -0.57 0.00 0.00 43.02 41.14 1ce8 s PHE 830 CO 0.03 0.50 -0.13 0.00 -0.10 0.00 0.00 175.22 175.51 1ce8 s ALA 831 N -2.75 1.35 -0.31 5.36 0.00 0.18 -0.88 121.76 124.72 1ce8 s ALA 831 Ca 0.30 -0.47 -0.05 0.00 0.00 0.00 0.00 51.96 51.74 1ce8 s ALA 831 Cb 0.01 -0.59 0.03 0.00 0.00 0.00 0.00 23.12 22.57 1ce8 s ALA 831 CO 0.14 0.13 0.06 0.08 0.00 0.00 0.00 175.76 176.17 1ce8 s VAL 832 N 0.64 3.60 -0.13 0.00 1.01 0.45 0.08 120.40 126.05 1ce8 s VAL 832 Ca -0.15 -1.02 -0.02 0.00 0.00 0.00 0.00 61.98 60.79 1ce8 s VAL 832 Cb -0.16 -2.96 0.04 0.00 0.00 0.00 0.00 36.38 33.30 1ce8 s VAL 832 CO 0.04 -0.04 0.01 -0.75 0.00 0.00 0.00 175.10 174.36 1ce8 s LYS 833 N 1.40 0.75 -1.20 2.72 2.20 -0.46 -2.15 119.74 122.99 1ce8 s LYS 833 Ca -0.01 -0.17 -0.05 0.00 -0.36 0.00 0.00 55.97 55.38 1ce8 s LYS 833 Cb -0.18 -1.55 0.01 0.00 -1.51 0.00 0.00 37.83 34.59 1ce8 s LYS 833 CO 0.01 -0.45 0.68 0.09 -0.36 0.00 0.00 175.35 175.33 1ce8 n ASN 834 N 5.08 -5.40 -0.51 1.43 5.03 -1.26 -2.42 115.26 117.20 1ce8 n ASN 834 Ca -0.09 -0.31 -0.06 0.00 0.87 0.00 0.00 54.58 54.99 1ce8 n ASN 834 Cb 0.49 -4.15 -0.02 0.00 -1.02 0.00 0.00 39.78 35.08 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 -1.89 -3.22 -4.23 6.41 4.05 -1.26 -5.02 115.26 110.10 1ce8 n ASN 835 Ca -0.05 0.09 -0.24 0.00 0.45 0.00 0.00 54.58 54.83 1ce8 n ASN 835 Cb 0.58 -1.70 -0.14 0.00 1.23 0.00 0.00 39.78 39.75 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 -3.11 1.26 -0.27 1.20 2.02 -1.02 -5.07 118.70 113.71 1ce8 s GLU 836 Ca 0.00 -0.91 -0.10 0.00 0.02 0.00 0.00 54.97 53.98 1ce8 s GLU 836 Cb 0.00 -1.36 -0.05 0.00 0.10 0.00 0.00 34.13 32.82 1ce8 s GLU 836 CO 0.00 0.34 0.16 0.08 0.02 0.00 0.00 175.26 175.87 1ce8 s VAL 837 N -0.84 5.13 0.03 2.63 1.01 -1.26 -1.36 120.40 125.75 1ce8 s VAL 837 Ca 0.06 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.22 1ce8 s VAL 837 Cb -0.09 -3.43 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 1ce8 s VAL 837 CO 0.02 0.28 -0.18 -0.31 0.00 0.00 0.00 175.10 174.91 1ce8 s TYR 838 N 1.63 2.56 -0.05 5.22 1.51 0.11 -4.38 117.35 123.94 1ce8 s TYR 838 Ca 0.07 -0.26 -0.20 0.00 -1.01 0.00 0.00 57.07 55.67 1ce8 s TYR 838 Cb -0.15 -1.47 -0.05 0.00 -0.11 0.00 0.00 41.96 40.18 1ce8 s TYR 838 CO 0.09 0.24 0.58 -1.17 -1.11 0.00 0.00 175.55 174.17 1ce8 s LEU 839 N -1.37 4.35 -0.20 -1.29 2.96 0.51 0.51 118.68 124.15 1ce8 s LEU 839 Ca 0.14 1.06 0.03 0.00 -0.22 0.00 0.00 54.13 55.13 1ce8 s LEU 839 Cb -0.10 -2.88 -0.14 0.00 0.50 0.00 0.00 46.19 43.57 1ce8 s LEU 839 CO 0.05 0.03 -0.16 -0.38 -1.32 0.00 0.00 176.35 174.57 1ce8 n ILE 840 N 3.22 1.15 -3.62 6.68 5.41 0.17 -4.30 119.36 128.08 1ce8 n ILE 840 Ca -0.06 -0.46 0.01 0.00 1.00 0.00 0.00 62.75 63.24 1ce8 n ILE 840 Cb 0.51 -1.17 -0.01 0.00 -0.71 0.00 0.00 39.64 38.27 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 -2.40 0.44 -0.04 0.38 -1.05 -1.14 -5.00 118.70 109.89 1ce8 s GLU 841 Ca -0.26 -0.24 0.01 0.00 -0.15 0.00 0.00 54.97 54.34 1ce8 s GLU 841 Cb 0.07 0.15 0.02 0.00 -0.44 0.00 0.00 34.13 33.93 1ce8 s GLU 841 CO 0.48 -0.20 -0.04 0.08 0.95 0.00 0.00 175.26 176.54 1ce8 s VAL 842 N -2.48 0.46 -0.38 1.83 1.01 -1.26 -1.66 120.40 117.93 1ce8 s VAL 842 Ca 0.14 -0.09 0.04 0.00 0.00 0.00 0.00 61.98 62.07 1ce8 s VAL 842 Cb 0.04 -0.49 0.11 0.00 0.00 0.00 0.00 36.38 36.03 1ce8 s VAL 842 CO -0.04 0.20 0.10 0.20 0.00 0.00 0.00 175.10 175.57 1ce8 s ASN 843 N 0.88 4.61 0.00 3.32 0.01 0.41 -4.61 114.94 119.56 1ce8 s ASN 843 Ca -0.11 -2.31 -0.03 0.00 -0.71 0.00 0.00 52.86 49.70 1ce8 s ASN 843 Cb -0.14 -1.57 -0.15 0.00 0.41 0.00 0.00 41.25 39.80 1ce8 s ASN 843 CO -0.00 -0.35 2.74 -0.81 -1.51 0.00 0.00 177.10 177.17 1ce8 n PRO 844 N 4.05 1.46 -3.58 -0.60 -0.04 -1.26 0.33 135.00 135.36 1ce8 n PRO 844 Ca 0.04 -0.56 -0.09 0.00 -0.04 0.00 0.00 63.50 62.85 1ce8 n PRO 844 Cb 0.40 -1.61 0.02 0.00 -0.04 0.00 0.00 33.50 32.26 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 2.18 0.98 -2.36 0.54 1.85 -1.17 -4.79 116.66 113.88 1ce8 n ARG 845 Ca 0.24 -2.13 -0.42 0.00 -1.00 0.00 0.00 57.85 54.54 1ce8 n ARG 845 Cb 0.69 2.53 -0.03 0.00 -1.05 0.00 0.00 32.46 34.60 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 -2.10 3.44 0.28 2.89 0.00 -1.03 -3.49 121.76 121.74 1ce8 s ALA 846 Ca 0.17 0.91 0.05 0.00 0.00 0.00 0.00 51.96 53.09 1ce8 s ALA 846 Cb -0.04 -3.46 -0.02 0.00 0.00 0.00 0.00 23.12 19.59 1ce8 s ALA 846 CO 0.12 -0.47 0.41 0.00 0.00 0.00 0.00 175.76 175.82 1ce8 s ALA 847 N 1.02 3.97 -0.16 0.00 0.00 -1.26 -4.83 121.76 120.50 1ce8 s ALA 847 Ca 0.60 -1.25 0.18 0.00 0.00 0.00 0.00 51.96 51.49 1ce8 s ALA 847 Cb -0.31 -1.77 0.97 0.00 0.00 0.00 0.00 23.12 22.01 1ce8 s ALA 847 CO 0.30 0.14 1.51 2.89 0.00 0.00 0.00 175.76 180.59 1ce8 n ARG 848 N -1.52 0.12 0.00 0.00 1.85 -1.26 -1.35 116.66 114.50 1ce8 n ARG 848 Ca -0.06 0.61 0.13 0.00 -1.00 0.00 0.00 57.85 57.53 1ce8 n ARG 848 Cb 0.57 -1.98 0.51 0.00 -1.05 0.00 0.00 32.46 30.50 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 -2.15 0.00 -0.13 8.89 -2.24 -1.26 -4.35 114.28 113.04 1ce8 n THR 849 Ca -0.01 -0.02 -0.04 0.00 -2.27 0.00 0.00 64.05 61.70 1ce8 n THR 849 Cb 0.13 -0.13 0.04 0.00 -2.10 0.00 0.00 70.33 68.27 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 0.21 0.80 -0.31 2.28 2.07 -1.59 -1.40 116.25 118.31 1ce8 h VAL 850 Ca 0.00 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1ce8 h VAL 850 Cb 0.45 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 1ce8 h VAL 850 CO 0.00 0.04 0.21 -0.65 0.02 0.00 0.00 177.57 177.19 1ce8 h PRO 851 N 0.24 0.42 -0.42 1.57 0.11 -1.83 -0.78 132.00 131.32 1ce8 h PRO 851 Ca 0.20 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 66.32 1ce8 h PRO 851 Cb 0.23 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 31.22 1ce8 h PRO 851 CO -0.25 0.28 0.20 0.35 -0.21 0.00 0.00 178.00 178.37 1ce8 h PHE 852 N 0.42 0.36 -0.49 0.65 3.57 -1.76 -0.18 116.94 119.51 1ce8 h PHE 852 Ca 0.11 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.58 1ce8 h PHE 852 Cb -0.04 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.57 1ce8 h PHE 852 CO -0.05 0.18 0.09 0.28 -2.23 0.00 0.00 178.31 176.57 1ce8 h VAL 853 N 0.40 1.22 -0.44 1.41 2.07 -0.93 0.97 116.25 120.94 1ce8 h VAL 853 Ca 0.18 -0.83 -0.01 0.00 0.82 0.00 0.00 66.70 66.86 1ce8 h VAL 853 Cb 0.10 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 1ce8 h VAL 853 CO -0.14 0.30 0.24 0.28 0.02 0.00 0.00 177.57 178.28 1ce8 h SER 854 N 0.74 0.55 -0.40 0.57 0.02 -0.43 0.13 113.55 114.73 1ce8 h SER 854 Ca 0.16 -0.09 -0.15 0.00 -0.84 0.00 0.00 61.79 60.86 1ce8 h SER 854 Cb 0.32 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 1ce8 h SER 854 CO 0.00 0.49 -0.34 0.11 -1.14 0.00 0.00 176.83 175.94 1ce8 h LYS 855 N 0.58 0.95 -0.40 3.45 1.79 -0.62 0.46 116.57 122.77 1ce8 h LYS 855 Ca 0.15 -0.48 -0.12 0.00 -2.18 0.00 0.00 60.65 58.03 1ce8 h LYS 855 Cb 0.06 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.70 1ce8 h LYS 855 CO -0.02 1.14 -0.22 0.00 -1.08 0.00 0.00 179.45 179.26 1ce8 h ALA 856 N 0.79 0.56 -0.00 3.86 0.00 -0.62 -3.31 119.26 120.53 1ce8 h ALA 856 Ca 0.07 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1ce8 h ALA 856 Cb 0.94 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1ce8 h ALA 856 CO 0.09 0.54 -0.80 0.25 0.00 0.00 0.00 179.25 179.33 1ce8 n THR 857 N -4.21 0.00 -0.67 0.00 -2.24 0.43 -4.85 114.28 102.75 1ce8 n THR 857 Ca -0.02 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1ce8 n THR 857 Cb 0.45 0.93 0.00 0.00 -2.10 0.00 0.00 70.33 69.61 1ce8 n THR 857 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ce8 n GLY 858 N 1.48 0.99 3.56 3.38 0.00 0.16 -4.98 105.19 109.78 1ce8 n GLY 858 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.93 5.13 -1.26 1.61 1.01 -1.19 -5.00 120.40 117.76 1ce8 s VAL 859 Ca 0.00 0.23 -0.19 0.00 0.00 0.00 0.00 61.98 62.02 1ce8 s VAL 859 Cb 0.00 -3.84 0.07 0.00 0.00 0.00 0.00 36.38 32.61 1ce8 s VAL 859 CO 0.00 -0.08 1.70 -2.16 0.00 0.00 0.00 175.10 174.56 1ce8 s PRO 860 N 2.13 3.92 0.32 2.72 0.04 -1.26 -4.10 135.00 138.78 1ce8 s PRO 860 Ca 0.14 -1.87 0.07 0.00 0.04 0.00 0.00 61.00 59.39 1ce8 s PRO 860 Cb -0.16 -5.51 0.78 0.00 0.04 0.00 0.00 34.50 29.65 1ce8 s PRO 860 CO 0.12 -2.26 1.79 -0.07 0.04 0.00 0.00 177.00 176.62 1ce8 h LEU 861 N 12.63 0.74 -0.98 -3.56 3.38 -1.93 0.77 115.31 126.37 1ce8 h LEU 861 Ca 0.41 0.09 -0.08 0.00 0.09 0.00 0.00 57.88 58.39 1ce8 h LEU 861 Cb 0.89 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 1ce8 h LEU 861 CO 1.45 0.27 -0.15 0.00 0.09 0.00 0.00 178.44 180.11 1ce8 h ALA 862 N 1.63 1.14 -0.10 1.53 0.00 -1.90 0.23 119.26 121.80 1ce8 h ALA 862 Ca 0.56 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 55.11 1ce8 h ALA 862 Cb 0.92 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 1ce8 h ALA 862 CO -0.34 0.54 -0.16 0.87 0.00 0.00 0.00 179.25 180.16 1ce8 h LYS 863 N 0.52 0.28 -0.37 0.00 1.57 -1.18 -1.32 116.57 116.07 1ce8 h LYS 863 Ca 0.09 -0.17 0.02 0.00 -1.87 0.00 0.00 60.65 58.71 1ce8 h LYS 863 Cb 0.56 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.87 1ce8 h LYS 863 CO 0.04 0.75 0.21 0.28 -0.57 0.00 0.00 179.45 180.16 1ce8 h VAL 864 N -0.17 1.03 0.00 0.50 2.07 -0.81 -1.88 116.25 116.99 1ce8 h VAL 864 Ca 0.01 -0.15 -0.08 0.00 0.82 0.00 0.00 66.70 67.30 1ce8 h VAL 864 Cb 0.73 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 1ce8 h VAL 864 CO 0.04 0.08 -0.38 0.00 0.02 0.00 0.00 177.57 177.32 1ce8 h ALA 865 N 1.17 1.20 -0.38 1.67 0.00 -0.54 -2.03 119.26 120.35 1ce8 h ALA 865 Ca 0.15 -0.35 -0.16 0.00 0.00 0.00 0.00 54.91 54.55 1ce8 h ALA 865 Cb 0.02 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1ce8 h ALA 865 CO -0.08 0.48 -0.40 0.00 0.00 0.00 0.00 179.25 179.25 1ce8 h ALA 866 N 1.62 0.56 -0.87 0.00 0.00 -0.94 -1.12 119.26 118.50 1ce8 h ALA 866 Ca -0.00 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 1ce8 h ALA 866 Cb 0.75 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 1ce8 h ALA 866 CO 0.05 0.68 0.53 0.00 0.00 0.00 0.00 179.25 180.50 1ce8 h ARG 867 N 0.76 1.18 -0.71 0.00 3.08 -1.10 -0.77 114.38 116.83 1ce8 h ARG 867 Ca 0.06 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 1ce8 h ARG 867 Cb 1.00 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.76 1ce8 h ARG 867 CO 0.10 0.83 0.37 0.28 -1.07 0.00 0.00 179.97 180.48 1ce8 h VAL 868 N 1.20 1.23 -0.58 2.04 2.07 -1.14 -0.43 116.25 120.64 1ce8 h VAL 868 Ca 0.31 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 67.21 1ce8 h VAL 868 Cb -0.05 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.00 1ce8 h VAL 868 CO -0.06 0.26 0.25 0.24 0.02 0.00 0.00 177.57 178.28 1ce8 h MET 869 N 0.99 0.83 0.00 1.57 2.86 -0.09 -0.63 114.93 120.46 1ce8 h MET 869 Ca 0.25 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 1ce8 h MET 869 Cb 0.07 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.58 1ce8 h MET 869 CO -0.04 0.67 0.00 0.00 1.06 0.00 0.00 176.91 178.60 1ce8 n ALA 870 N -2.45 2.41 0.00 6.32 0.00 -0.40 -3.99 120.51 122.39 1ce8 n ALA 870 Ca 0.05 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1ce8 n ALA 870 Cb 0.15 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1ce8 n ALA 870 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ce8 n GLY 871 N 1.09 2.09 3.62 0.00 0.00 -0.24 -5.07 105.19 106.66 1ce8 n GLY 871 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 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 3.91 0.84 1.61 2.20 -0.25 -4.95 119.74 123.10 1ce8 s LYS 872 Ca 0.00 0.74 -0.11 0.00 -0.36 0.00 0.00 55.97 56.24 1ce8 s LYS 872 Cb 0.00 -3.79 0.10 0.00 -1.51 0.00 0.00 37.83 32.63 1ce8 s LYS 872 CO 0.00 -0.97 1.15 -1.54 -0.36 0.00 0.00 175.35 173.63 1ce8 s SER 873 N 1.85 3.58 0.11 1.43 1.04 -1.26 -3.04 113.70 117.42 1ce8 s SER 873 Ca 0.41 2.15 -0.18 0.00 0.48 0.00 0.00 55.95 58.80 1ce8 s SER 873 Cb -0.12 -2.56 -0.05 0.00 0.10 0.00 0.00 66.02 63.39 1ce8 s SER 873 CO 0.19 -2.66 1.67 -0.07 0.98 0.00 0.00 173.24 173.35 1ce8 h LEU 874 N -1.32 0.36 -0.82 2.42 3.38 -1.95 -1.40 115.31 115.98 1ce8 h LEU 874 Ca -0.44 -0.14 0.15 0.00 0.09 0.00 0.00 57.88 57.54 1ce8 h LEU 874 Cb 1.27 -0.09 -0.10 0.00 0.09 0.00 0.00 40.66 41.82 1ce8 h LEU 874 CO 0.46 0.40 0.38 0.00 0.09 0.00 0.00 178.44 179.77 1ce8 h ALA 875 N 0.98 1.22 -0.05 1.53 0.00 -1.93 0.42 119.26 121.43 1ce8 h ALA 875 Ca 0.09 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 1ce8 h ALA 875 Cb 0.14 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1ce8 h ALA 875 CO -0.01 -0.16 -0.41 0.93 0.00 0.00 0.00 179.25 179.60 1ce8 h GLU 876 N 0.53 0.10 0.00 0.00 5.08 -1.83 -2.24 114.58 116.21 1ce8 h GLU 876 Ca 0.46 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.77 1ce8 h GLU 876 Cb 0.69 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.94 1ce8 h GLU 876 CO -0.40 0.49 -0.41 1.96 -1.00 0.00 0.00 179.01 179.66 1ce8 h GLN 877 N 0.08 0.00 -0.23 2.33 4.20 0.04 -3.47 115.11 118.06 1ce8 h GLN 877 Ca 0.01 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.66 1ce8 h GLN 877 Cb 0.76 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.53 1ce8 h GLN 877 CO 0.06 0.00 -0.06 0.41 -0.67 0.00 0.00 178.83 178.57 1ce8 n GLY 878 N 1.16 0.49 3.14 3.46 0.00 0.13 -4.99 105.19 108.58 1ce8 n GLY 878 Ca 0.03 -0.89 -0.38 0.00 0.00 0.00 0.00 46.02 44.78 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 -2.12 4.23 0.00 1.61 1.01 -0.55 -4.77 120.40 119.81 1ce8 s VAL 879 Ca 0.00 -3.18 0.00 0.00 0.00 0.00 0.00 61.98 58.80 1ce8 s VAL 879 Cb 0.00 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.70 1ce8 s VAL 879 CO 0.00 -0.97 0.00 0.35 0.00 0.00 0.00 175.10 174.48 1ce8 n THR 880 N 3.18 0.00 -4.67 3.92 -2.24 -1.26 -4.58 114.28 108.63 1ce8 n THR 880 Ca 0.13 -0.35 -0.33 0.00 -2.27 0.00 0.00 64.05 61.23 1ce8 n THR 880 Cb 0.39 0.92 -0.12 0.00 -2.10 0.00 0.00 70.33 69.42 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 -0.91 2.90 0.21 -0.78 -0.14 -1.26 -4.93 119.74 114.83 1ce8 s LYS 881 Ca 0.00 -0.59 -0.31 0.00 -1.36 0.00 0.00 55.97 53.71 1ce8 s LYS 881 Cb 0.00 -2.59 -0.11 0.00 -1.68 0.00 0.00 37.83 33.45 1ce8 s LYS 881 CO 0.00 0.54 1.57 -2.00 -0.76 0.00 0.00 175.35 174.70 1ce8 s GLU 882 N -0.49 4.20 -0.17 1.68 2.12 -1.26 -4.97 118.70 119.80 1ce8 s GLU 882 Ca 0.07 2.42 -0.17 0.00 0.36 0.00 0.00 54.97 57.65 1ce8 s GLU 882 Cb -0.12 -3.11 -0.04 0.00 0.26 0.00 0.00 34.13 31.12 1ce8 s GLU 882 CO 0.02 -0.59 0.44 0.08 -0.54 0.00 0.00 175.26 174.67 1ce8 s VAL 883 N 0.71 5.19 -0.32 3.70 1.01 -1.26 -5.03 120.40 124.40 1ce8 s VAL 883 Ca 0.67 0.83 0.04 0.00 0.00 0.00 0.00 61.98 63.52 1ce8 s VAL 883 Cb -0.45 -3.77 0.09 0.00 0.00 0.00 0.00 36.38 32.25 1ce8 s VAL 883 CO 0.37 0.28 0.00 -0.63 0.00 0.00 0.00 175.10 175.12 1ce8 s ILE 884 N 1.03 2.25 0.60 2.22 -1.09 -1.26 -4.95 121.20 120.00 1ce8 s ILE 884 Ca 0.22 -2.14 -0.18 0.00 -2.23 0.00 0.00 60.65 56.32 1ce8 s ILE 884 Cb -0.15 -2.57 -0.03 0.00 -1.58 0.00 0.00 42.46 38.13 1ce8 s ILE 884 CO 0.09 -0.43 1.19 -2.84 -1.23 0.00 0.00 174.94 171.72 1ce8 s PRO 885 N 0.96 2.95 0.00 2.79 0.02 -1.26 -4.93 135.00 135.52 1ce8 s PRO 885 Ca 0.05 1.77 0.28 0.00 0.02 0.00 0.00 61.00 63.12 1ce8 s PRO 885 Cb -0.19 -1.93 1.25 0.00 0.02 0.00 0.00 34.50 33.64 1ce8 s PRO 885 CO -0.07 -1.21 1.91 -0.35 -0.33 0.00 0.00 177.00 176.95 1ce8 n PRO 886 N -1.69 0.11 -4.61 5.54 -0.04 -1.26 -4.85 135.00 128.20 1ce8 n PRO 886 Ca 0.13 0.02 -0.28 0.00 -0.04 0.00 0.00 63.50 63.34 1ce8 n PRO 886 Cb 0.50 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.36 1ce8 n PRO 886 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1ce8 s TYR 887 N -2.89 2.30 -0.10 0.54 -0.85 -1.26 -4.98 117.35 110.12 1ce8 s TYR 887 Ca 0.17 -0.78 -0.16 0.00 -0.52 0.00 0.00 57.07 55.77 1ce8 s TYR 887 Cb 0.18 -1.65 -0.05 0.00 0.38 0.00 0.00 41.96 40.83 1ce8 s TYR 887 CO 0.48 0.32 0.41 0.71 -1.52 0.00 0.00 175.55 175.95 1ce8 s TYR 888 N -2.85 3.55 -0.21 -3.49 2.02 0.10 -4.48 117.35 111.99 1ce8 s TYR 888 Ca 0.30 0.84 0.01 0.00 -0.37 0.00 0.00 57.07 57.86 1ce8 s TYR 888 Cb 0.08 -2.43 0.04 0.00 -0.40 0.00 0.00 41.96 39.25 1ce8 s TYR 888 CO 0.15 0.30 -0.13 -1.12 -1.57 0.00 0.00 175.55 173.18 1ce8 s SER 889 N 0.17 3.59 -0.09 2.29 0.01 0.46 -0.99 113.70 119.15 1ce8 s SER 889 Ca 0.23 -0.95 0.03 0.00 1.31 0.00 0.00 55.95 56.57 1ce8 s SER 889 Cb -0.15 -1.39 -0.01 0.00 0.21 0.00 0.00 66.02 64.68 1ce8 s SER 889 CO 0.09 -0.11 -0.18 -0.69 0.41 0.00 0.00 173.24 172.76 1ce8 s VAL 890 N 1.29 2.61 -0.12 3.43 1.01 -0.13 -0.29 120.40 128.20 1ce8 s VAL 890 Ca -0.01 -0.84 -0.03 0.00 0.00 0.00 0.00 61.98 61.09 1ce8 s VAL 890 Cb -0.16 -2.03 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 1ce8 s VAL 890 CO -0.09 0.56 0.01 -0.75 0.00 0.00 0.00 175.10 174.83 1ce8 s LYS 891 N 0.01 3.31 0.13 2.72 2.20 0.15 -0.70 119.74 127.56 1ce8 s LYS 891 Ca -0.06 -0.40 0.06 0.00 -0.36 0.00 0.00 55.97 55.21 1ce8 s LYS 891 Cb -0.15 -2.91 -0.04 0.00 -1.51 0.00 0.00 37.83 33.23 1ce8 s LYS 891 CO 0.05 0.54 -0.15 -2.00 -0.36 0.00 0.00 175.35 173.43 1ce8 s GLU 892 N -0.44 1.08 0.40 4.03 2.56 -0.61 -0.75 118.70 124.97 1ce8 s GLU 892 Ca 0.08 -1.29 0.08 0.00 0.00 0.00 0.00 54.97 53.84 1ce8 s GLU 892 Cb -0.12 -1.00 -0.05 0.00 2.00 0.00 0.00 34.13 34.97 1ce8 s GLU 892 CO 0.02 0.19 0.18 0.14 -0.56 0.00 0.00 175.26 175.24 1ce8 s VAL 893 N -2.16 2.45 -0.05 3.70 -7.23 -1.26 -0.69 120.40 115.17 1ce8 s VAL 893 Ca 0.11 -1.68 0.05 0.00 -1.81 0.00 0.00 61.98 58.64 1ce8 s VAL 893 Cb -0.05 -2.98 -0.01 0.00 0.56 0.00 0.00 36.38 33.90 1ce8 s VAL 893 CO 0.04 -0.04 -0.19 0.68 -0.31 0.00 0.00 175.10 175.28 1ce8 s VAL 894 N -2.56 1.60 0.07 1.32 -7.23 -0.20 -4.91 120.40 108.49 1ce8 s VAL 894 Ca 0.41 -0.82 0.07 0.00 -1.81 0.00 0.00 61.98 59.84 1ce8 s VAL 894 Cb 0.02 -1.37 -0.04 0.00 0.56 0.00 0.00 36.38 35.56 1ce8 s VAL 894 CO 0.23 0.46 -0.16 -0.76 -0.31 0.00 0.00 175.10 174.56 1ce8 s LEU 895 N -0.04 2.76 0.00 1.32 1.43 -1.26 -1.74 118.68 121.15 1ce8 s LEU 895 Ca -0.03 -0.43 0.25 0.00 -1.03 0.00 0.00 54.13 52.89 1ce8 s LEU 895 Cb -0.12 -1.61 1.49 0.00 0.03 0.00 0.00 46.19 45.98 1ce8 s LEU 895 CO 0.02 0.22 1.88 -0.81 0.23 0.00 0.00 176.35 177.90 1ce8 n PRO 896 N 1.20 0.73 -0.31 1.29 -0.04 -1.26 -4.44 135.00 132.16 1ce8 n PRO 896 Ca -0.15 0.01 0.10 0.00 -0.04 0.00 0.00 63.50 63.41 1ce8 n PRO 896 Cb 0.52 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.70 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 -0.13 -0.18 0.54 0.04 -1.92 0.29 116.94 115.58 1ce8 h PHE 897 Ca 0.00 0.07 0.05 0.00 2.80 0.00 0.00 57.97 60.89 1ce8 h PHE 897 Cb 0.04 0.20 -0.01 0.00 2.20 0.00 0.00 35.95 38.38 1ce8 h PHE 897 CO 0.00 -0.36 0.21 -2.95 -0.60 0.00 0.00 178.31 174.61 1ce8 h ASN 898 N 0.04 0.00 1.20 2.17 -1.07 -1.98 -0.59 115.58 115.35 1ce8 h ASN 898 Ca 0.51 0.00 -0.08 0.00 0.07 0.00 0.00 56.30 56.80 1ce8 h ASN 898 Cb 0.96 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.20 1ce8 h ASN 898 CO -0.85 0.00 -0.40 0.11 0.07 0.00 0.00 177.43 176.37 1ce8 h LYS 899 N 0.00 0.00 -2.11 4.14 1.79 -0.76 -3.35 116.57 116.28 1ce8 h LYS 899 Ca 0.08 0.00 -0.58 0.00 -2.18 0.00 0.00 60.65 57.97 1ce8 h LYS 899 Cb 0.50 0.00 -0.41 0.00 -1.58 0.00 0.00 32.23 30.74 1ce8 h LYS 899 CO -0.00 0.40 -0.84 1.19 -1.08 0.00 0.00 179.45 179.11 1ce8 n PHE 900 N -3.34 1.69 -0.35 -1.35 3.72 -0.24 -4.96 117.46 112.63 1ce8 n PHE 900 Ca 0.01 -3.87 0.29 0.00 -0.05 0.00 0.00 57.45 53.83 1ce8 n PHE 900 Cb 0.60 -0.45 0.55 0.00 -0.94 0.00 0.00 39.48 39.24 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 4.12 0.17 0.00 -1.08 0.13 -1.69 0.19 132.00 133.85 1ce8 h PRO 901 Ca 0.14 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1ce8 h PRO 901 Cb 0.77 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1ce8 h PRO 901 CO 0.65 0.11 0.00 0.41 -0.23 0.00 0.00 178.00 178.95 1ce8 n GLY 902 N -1.33 -0.48 3.86 1.56 0.00 -1.26 -4.71 105.19 102.83 1ce8 n GLY 902 Ca 0.35 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.62 4.95 -0.53 1.61 1.01 0.68 -4.66 120.40 120.84 1ce8 s VAL 903 Ca 0.05 0.57 -0.29 0.00 0.00 0.00 0.00 61.98 62.31 1ce8 s VAL 903 Cb 0.03 -3.67 0.03 0.00 0.00 0.00 0.00 36.38 32.78 1ce8 s VAL 903 CO 0.08 0.12 1.19 -0.62 0.00 0.00 0.00 175.10 175.87 1ce8 s ASP 904 N -2.01 6.50 -0.58 3.32 2.15 -1.26 -4.87 116.67 119.91 1ce8 s ASP 904 Ca 0.41 0.29 -0.04 0.00 0.43 0.00 0.00 52.55 53.64 1ce8 s ASP 904 Cb -0.13 -2.55 -0.03 0.00 -0.30 0.00 0.00 42.92 39.90 1ce8 s ASP 904 CO 0.20 -1.41 1.71 -0.81 -0.17 0.00 0.00 175.17 174.69 1ce8 n PRO 905 N 8.21 1.33 -4.77 4.34 -0.04 -1.26 -4.83 135.00 137.98 1ce8 n PRO 905 Ca 0.10 -1.11 -0.25 0.00 -0.04 0.00 0.00 63.50 62.21 1ce8 n PRO 905 Cb 0.49 -2.29 -0.16 0.00 -0.04 0.00 0.00 33.50 31.51 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 0.06 1.95 0.66 1.53 2.96 -1.26 -4.99 118.68 119.59 1ce8 s LEU 906 Ca 0.25 -0.31 -0.14 0.00 -0.22 0.00 0.00 54.13 53.70 1ce8 s LEU 906 Cb 0.06 -0.88 -0.00 0.00 0.50 0.00 0.00 46.19 45.88 1ce8 s LEU 906 CO -0.02 0.17 1.10 -0.76 -1.32 0.00 0.00 176.35 175.51 1ce8 s LEU 907 N -0.13 3.36 0.00 -0.68 1.43 -1.26 -5.04 118.68 116.36 1ce8 s LEU 907 Ca 0.01 1.93 0.00 0.00 -1.03 0.00 0.00 54.13 55.03 1ce8 s LEU 907 Cb -0.09 -4.54 0.00 0.00 0.03 0.00 0.00 46.19 41.59 1ce8 s LEU 907 CO 0.01 -1.57 0.00 0.61 0.23 0.00 0.00 176.35 175.62 1ce8 n GLY 908 N -0.75 1.41 0.09 -3.19 0.00 -1.26 -5.00 105.19 96.49 1ce8 n GLY 908 Ca 0.10 -0.82 0.11 0.00 0.00 0.00 0.00 46.02 45.41 1ce8 n GLY 908 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ce8 n PRO 909 N 0.00 0.15 -4.06 1.61 -0.04 -0.77 -0.07 135.00 131.81 1ce8 n PRO 909 Ca 0.00 0.34 -0.34 0.00 -0.04 0.00 0.00 63.50 63.46 1ce8 n PRO 909 Cb 0.00 -1.77 -0.10 0.00 -0.04 0.00 0.00 33.50 31.59 1ce8 n PRO 909 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1ce8 s GLU 910 N -3.21 3.92 0.07 0.54 2.12 -1.26 -4.34 118.70 116.53 1ce8 s GLU 910 Ca 0.06 -0.36 -0.30 0.00 0.36 0.00 0.00 54.97 54.73 1ce8 s GLU 910 Cb 0.10 -3.17 -0.05 0.00 0.26 0.00 0.00 34.13 31.27 1ce8 s GLU 910 CO 0.40 0.29 1.03 1.41 -0.54 0.00 0.00 175.26 177.84 1ce8 s MET 911 N 0.32 4.58 0.00 4.30 -2.45 -1.26 -4.74 119.30 120.06 1ce8 s MET 911 Ca 0.02 1.53 0.00 0.00 -1.25 0.00 0.00 55.69 56.00 1ce8 s MET 911 Cb -0.13 -3.39 0.00 0.00 1.25 0.00 0.00 34.83 32.56 1ce8 s MET 911 CO 0.00 0.01 0.09 0.54 1.05 0.00 0.00 175.02 176.71 1ce8 n ARG 912 N 3.36 2.50 -2.11 4.11 3.00 -1.26 -4.91 116.66 121.34 1ce8 n ARG 912 Ca 0.05 -0.09 -0.36 0.00 -0.01 0.00 0.00 57.85 57.44 1ce8 n ARG 912 Cb 0.49 -0.44 0.02 0.00 0.00 0.00 0.00 32.46 32.53 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 -0.38 5.55 -0.15 0.55 1.04 -1.26 -4.29 113.70 114.75 1ce8 s SER 913 Ca 0.00 2.34 0.18 0.00 0.48 0.00 0.00 55.95 58.95 1ce8 s SER 913 Cb 0.00 -2.60 -0.26 0.00 0.10 0.00 0.00 66.02 63.27 1ce8 s SER 913 CO 0.00 -1.35 0.21 0.35 0.98 0.00 0.00 173.24 173.43 1ce8 n THR 914 N -1.24 1.20 -3.83 2.02 -2.24 -0.71 -4.48 114.28 104.99 1ce8 n THR 914 Ca 0.12 -0.80 -0.10 0.00 -2.27 0.00 0.00 64.05 61.00 1ce8 n THR 914 Cb 0.49 -0.46 -0.01 0.00 -2.10 0.00 0.00 70.33 68.26 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 1.65 1.91 3.18 3.38 0.00 -1.07 -4.68 105.19 109.56 1ce8 n GLY 915 Ca -0.26 -1.43 -0.09 0.00 0.00 0.00 0.00 46.02 44.24 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 -2.43 0.78 0.23 1.61 -1.05 -1.26 -1.04 118.70 115.54 1ce8 s GLU 916 Ca 0.19 -0.98 0.04 0.00 -0.15 0.00 0.00 54.97 54.07 1ce8 s GLU 916 Cb -0.02 0.31 -0.05 0.00 -0.44 0.00 0.00 34.13 33.93 1ce8 s GLU 916 CO 0.14 -0.23 -0.03 0.14 0.95 0.00 0.00 175.26 176.23 1ce8 s VAL 917 N -3.76 1.19 0.02 1.83 -7.23 0.14 -4.25 120.40 108.33 1ce8 s VAL 917 Ca 0.04 -2.06 0.04 0.00 -1.81 0.00 0.00 61.98 58.19 1ce8 s VAL 917 Cb 0.05 -2.28 -0.02 0.00 0.56 0.00 0.00 36.38 34.70 1ce8 s VAL 917 CO -0.10 -0.39 -0.11 -0.32 -0.31 0.00 0.00 175.10 173.86 1ce8 s MET 918 N -3.81 0.82 -0.04 4.82 0.00 -0.36 -1.58 119.30 119.16 1ce8 s MET 918 Ca 0.27 -0.58 0.03 0.00 0.00 0.00 0.00 55.69 55.41 1ce8 s MET 918 Cb 0.05 -0.79 0.00 0.00 0.00 0.00 0.00 34.83 34.09 1ce8 s MET 918 CO 0.08 0.20 -0.13 0.20 0.00 0.00 0.00 175.02 175.37 1ce8 s GLY 919 N -0.80 0.72 -0.14 2.11 0.00 0.12 -4.53 107.32 104.80 1ce8 s GLY 919 Ca 0.01 -0.49 -0.00 0.00 0.00 0.00 0.00 44.72 44.24 1ce8 s GLY 919 CO 0.00 -0.17 -0.14 0.14 0.00 0.00 0.00 173.10 172.94 1ce8 s VAL 920 N 0.19 2.88 0.09 1.40 1.01 -1.26 -0.96 120.40 123.76 1ce8 s VAL 920 Ca -0.05 -0.71 -0.05 0.00 0.00 0.00 0.00 61.98 61.17 1ce8 s VAL 920 Cb -0.11 -2.22 -0.02 0.00 0.00 0.00 0.00 36.38 34.04 1ce8 s VAL 920 CO 0.02 0.52 0.12 -0.83 0.00 0.00 0.00 175.10 174.92 1ce8 s GLY 921 N 0.60 0.37 0.47 4.51 0.00 -0.16 -4.50 107.32 108.62 1ce8 s GLY 921 Ca -0.08 -0.94 0.29 0.00 0.00 0.00 0.00 44.72 43.99 1ce8 s GLY 921 CO 0.03 -1.03 1.85 3.21 0.00 0.00 0.00 173.10 177.16 1ce8 h ARG 922 N 2.85 0.00 -4.54 2.90 3.08 -1.92 0.29 114.38 117.04 1ce8 h ARG 922 Ca -0.34 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.49 1ce8 h ARG 922 Cb 1.19 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 31.09 1ce8 h ARG 922 CO 0.58 0.00 -0.63 0.95 -1.07 0.00 0.00 179.97 179.81 1ce8 s THR 923 N -3.48 0.03 0.25 2.04 -4.23 -1.26 -4.65 115.64 104.34 1ce8 s THR 923 Ca 0.04 -1.97 -0.05 0.00 -1.18 0.00 0.00 61.69 58.53 1ce8 s THR 923 Cb 0.08 -2.37 0.18 0.00 1.34 0.00 0.00 72.50 71.73 1ce8 s THR 923 CO 0.56 -0.13 1.83 0.15 -0.54 0.00 0.00 174.62 176.49 1ce8 h PHE 924 N 2.69 1.08 -0.36 3.99 3.57 -1.94 -0.50 116.94 125.46 1ce8 h PHE 924 Ca -0.36 -0.07 0.02 0.00 3.53 0.00 0.00 57.97 61.09 1ce8 h PHE 924 Cb 1.24 -0.33 -0.02 0.00 2.79 0.00 0.00 35.95 39.62 1ce8 h PHE 924 CO 0.37 0.81 0.21 0.00 -2.23 0.00 0.00 178.31 177.47 1ce8 h ALA 925 N 1.28 0.45 0.26 2.41 0.00 -1.96 -0.36 119.26 121.35 1ce8 h ALA 925 Ca 0.25 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1ce8 h ALA 925 Cb 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1ce8 h ALA 925 CO -0.02 -0.14 -0.13 1.49 0.00 0.00 0.00 179.25 180.45 1ce8 h GLU 926 N 0.42 -0.34 -0.79 0.00 4.81 -1.77 -0.34 114.58 116.58 1ce8 h GLU 926 Ca 0.14 0.02 0.12 0.00 -0.13 0.00 0.00 59.36 59.51 1ce8 h GLU 926 Cb 0.01 0.08 -0.08 0.00 0.63 0.00 0.00 28.75 29.38 1ce8 h GLU 926 CO -0.07 -0.23 0.40 0.00 -0.73 0.00 0.00 179.01 178.39 1ce8 h ALA 927 N 0.38 1.13 -0.46 2.92 0.00 -0.87 -1.98 119.26 120.37 1ce8 h ALA 927 Ca -0.04 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1ce8 h ALA 927 Cb 0.28 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1ce8 h ALA 927 CO 0.06 -0.05 -0.03 0.35 0.00 0.00 0.00 179.25 179.58 1ce8 h PHE 928 N 0.63 0.83 -0.31 0.00 3.57 -0.74 -0.99 116.94 119.93 1ce8 h PHE 928 Ca 0.41 -0.12 -0.16 0.00 3.53 0.00 0.00 57.97 61.62 1ce8 h PHE 928 Cb 0.49 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 1ce8 h PHE 928 CO -0.10 0.78 -0.44 0.00 -2.23 0.00 0.00 178.31 176.33 1ce8 h ALA 929 N 1.25 0.64 -0.26 2.41 0.00 -0.54 -0.51 119.26 122.24 1ce8 h ALA 929 Ca 0.14 -0.47 -0.13 0.00 0.00 0.00 0.00 54.91 54.44 1ce8 h ALA 929 Cb 0.48 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1ce8 h ALA 929 CO 0.02 0.67 -0.39 0.87 0.00 0.00 0.00 179.25 180.43 1ce8 h LYS 930 N 0.64 0.60 -0.23 0.00 1.57 -0.99 0.13 116.57 118.29 1ce8 h LYS 930 Ca 0.04 -0.30 -0.10 0.00 -1.87 0.00 0.00 60.65 58.42 1ce8 h LYS 930 Cb 1.01 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.32 1ce8 h LYS 930 CO 0.10 0.89 -0.25 0.00 -0.57 0.00 0.00 179.45 179.62 1ce8 h ALA 931 N 1.07 0.34 -0.34 3.86 0.00 -1.11 0.94 119.26 124.03 1ce8 h ALA 931 Ca 0.05 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 1ce8 h ALA 931 Cb 0.89 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1ce8 h ALA 931 CO 0.08 0.32 0.15 0.37 0.00 0.00 0.00 179.25 180.17 1ce8 h GLN 932 N 0.27 0.49 -0.50 0.00 4.15 -1.03 0.29 115.11 118.78 1ce8 h GLN 932 Ca 0.03 -0.08 -0.08 0.00 0.77 0.00 0.00 58.65 59.30 1ce8 h GLN 932 Cb 0.81 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 28.40 1ce8 h GLN 932 CO 0.06 0.47 0.02 1.25 -1.93 0.00 0.00 178.83 178.69 1ce8 h LEU 933 N 0.41 0.85 -1.82 -2.39 5.85 -0.96 -2.47 115.31 114.78 1ce8 h LEU 933 Ca 0.12 -0.30 0.02 0.00 0.84 0.00 0.00 57.88 58.56 1ce8 h LEU 933 Cb 0.14 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.93 1ce8 h LEU 933 CO -0.01 0.94 0.16 1.23 -0.34 0.00 0.00 178.44 180.42 1ce8 h GLY 934 N 0.74 0.27 0.33 3.75 0.00 -0.40 0.76 103.07 108.52 1ce8 h GLY 934 Ca 0.14 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1ce8 h GLY 934 CO 0.02 0.09 0.00 -1.14 0.00 0.00 0.00 176.54 175.51 1ce8 n SER 935 N -4.50 0.00 -0.25 0.19 3.41 0.98 -4.75 113.62 108.71 1ce8 n SER 935 Ca 0.01 -1.52 -0.03 0.00 -0.26 0.00 0.00 58.87 57.07 1ce8 n SER 935 Cb 0.14 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.08 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 -0.67 -2.92 -4.77 4.04 4.05 0.26 -4.91 115.26 110.35 1ce8 n ASN 936 Ca 0.07 0.05 -0.40 0.00 0.45 0.00 0.00 54.58 54.75 1ce8 n ASN 936 Cb 0.03 -1.10 -0.02 0.00 1.23 0.00 0.00 39.78 39.92 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 6.77 -0.37 1.20 0.15 -1.04 -4.91 113.70 112.55 1ce8 s SER 937 Ca 0.00 2.58 0.08 0.00 0.70 0.00 0.00 55.95 59.31 1ce8 s SER 937 Cb 0.00 -2.64 0.73 0.00 -1.71 0.00 0.00 66.02 62.40 1ce8 s SER 937 CO 0.00 -0.52 1.86 0.35 1.20 0.00 0.00 173.24 176.12 1ce8 n THR 938 N 0.70 3.05 -2.14 6.45 -2.24 -1.26 -4.83 114.28 114.01 1ce8 n THR 938 Ca 0.01 -1.74 -0.41 0.00 -2.27 0.00 0.00 64.05 59.64 1ce8 n THR 938 Cb 0.43 -0.40 -0.02 0.00 -2.10 0.00 0.00 70.33 68.24 1ce8 n THR 938 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1ce8 s MET 939 N -3.11 4.37 0.36 -0.78 0.00 -1.26 -4.33 119.30 114.55 1ce8 s MET 939 Ca 0.56 2.19 0.08 0.00 0.00 0.00 0.00 55.69 58.52 1ce8 s MET 939 Cb 0.46 -3.08 -0.04 0.00 0.00 0.00 0.00 34.83 32.17 1ce8 s MET 939 CO 0.13 -0.16 0.18 0.15 0.00 0.00 0.00 175.02 175.32 1ce8 s LYS 940 N -1.73 2.37 0.00 4.11 -0.14 -1.25 -5.04 119.74 118.06 1ce8 s LYS 940 Ca 0.49 -1.60 0.23 0.00 -1.36 0.00 0.00 55.97 53.73 1ce8 s LYS 940 Cb -0.39 -2.17 0.49 0.00 -1.68 0.00 0.00 37.83 34.08 1ce8 s LYS 940 CO 0.52 0.03 1.44 1.63 -0.76 0.00 0.00 175.35 178.20 1ce8 n LYS 941 N -1.22 2.49 -3.99 1.68 5.02 -1.26 -4.96 118.16 115.92 1ce8 n LYS 941 Ca -0.02 -2.26 -0.10 0.00 -2.02 0.00 0.00 58.31 53.92 1ce8 n LYS 941 Cb 0.62 -1.51 -0.04 0.00 -0.02 0.00 0.00 35.03 34.07 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 -1.44 0.43 0.00 2.13 -3.43 -1.26 -4.90 115.29 106.82 1ce8 s HIS 942 Ca 0.40 -0.81 0.00 0.00 -0.80 0.00 0.00 55.06 53.85 1ce8 s HIS 942 Cb 0.23 0.23 0.00 0.00 -1.43 0.00 0.00 32.58 31.61 1ce8 s HIS 942 CO 0.31 -1.09 0.00 0.41 -2.00 0.00 0.00 174.74 172.38 1ce8 n GLY 943 N -0.43 -0.36 3.60 -1.38 0.00 -1.26 -4.75 105.19 100.60 1ce8 n GLY 943 Ca -0.02 -2.08 -0.34 0.00 0.00 0.00 0.00 46.02 43.58 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 3.35 -0.04 1.61 3.52 -1.26 -0.67 118.95 125.47 1ce8 s ARG 944 Ca 0.00 -0.45 0.01 0.00 -0.13 0.00 0.00 55.73 55.16 1ce8 s ARG 944 Cb 0.00 -2.88 -0.03 0.00 -1.56 0.00 0.00 34.95 30.48 1ce8 s ARG 944 CO 0.00 0.47 -0.04 0.00 -0.81 0.00 0.00 175.30 174.92 1ce8 s ALA 945 N -0.26 3.10 -0.20 6.12 0.00 -0.46 -1.24 121.76 128.83 1ce8 s ALA 945 Ca 0.05 -0.92 -0.03 0.00 0.00 0.00 0.00 51.96 51.06 1ce8 s ALA 945 Cb -0.12 -1.27 -0.01 0.00 0.00 0.00 0.00 23.12 21.71 1ce8 s ALA 945 CO 0.02 0.60 -0.05 -1.17 0.00 0.00 0.00 175.76 175.16 1ce8 s LEU 946 N -1.13 2.97 -0.19 0.00 2.96 0.96 -0.78 118.68 123.46 1ce8 s LEU 946 Ca 0.15 -0.32 -0.04 0.00 -0.22 0.00 0.00 54.13 53.71 1ce8 s LEU 946 Cb -0.11 -1.74 -0.02 0.00 0.50 0.00 0.00 46.19 44.82 1ce8 s LEU 946 CO 0.05 0.05 -0.04 -0.76 -1.32 0.00 0.00 176.35 174.32 1ce8 s LEU 947 N 1.09 3.02 -0.40 -0.68 1.02 0.43 -0.49 118.68 122.67 1ce8 s LEU 947 Ca 0.01 -0.29 0.05 0.00 0.02 0.00 0.00 54.13 53.92 1ce8 s LEU 947 Cb -0.15 -1.75 0.17 0.00 0.02 0.00 0.00 46.19 44.48 1ce8 s LEU 947 CO -0.00 0.05 0.50 -0.55 0.02 0.00 0.00 176.35 176.37 1ce8 s SER 948 N 1.06 -0.07 0.24 2.29 0.15 -0.61 -2.16 113.70 114.59 1ce8 s SER 948 Ca 0.01 -1.40 0.11 0.00 0.70 0.00 0.00 55.95 55.37 1ce8 s SER 948 Cb -0.15 1.15 -0.05 0.00 -1.71 0.00 0.00 66.02 65.27 1ce8 s SER 948 CO 0.00 -0.20 -0.19 0.68 1.20 0.00 0.00 173.24 174.73 1ce8 s VAL 949 N 1.44 2.23 0.89 4.45 -7.23 -1.26 -1.78 120.40 119.14 1ce8 s VAL 949 Ca 0.19 -2.27 -0.11 0.00 -1.81 0.00 0.00 61.98 57.98 1ce8 s VAL 949 Cb -0.09 -2.17 0.13 0.00 0.56 0.00 0.00 36.38 34.81 1ce8 s VAL 949 CO -0.05 -0.40 1.09 0.00 -0.31 0.00 0.00 175.10 175.43 1ce8 s ARG 950 N -3.36 1.27 0.18 4.82 1.70 -0.48 -4.74 118.95 118.34 1ce8 s ARG 950 Ca 0.26 0.90 -0.23 0.00 -0.47 0.00 0.00 55.73 56.19 1ce8 s ARG 950 Cb -0.04 -1.80 0.08 0.00 -0.57 0.00 0.00 34.95 32.61 1ce8 s ARG 950 CO 0.12 -2.25 1.46 -1.91 -1.08 0.00 0.00 175.30 171.63 1ce8 n GLU 951 N -3.90 -0.32 0.15 3.89 4.07 -1.26 -0.75 120.64 122.52 1ce8 n GLU 951 Ca 0.07 1.44 0.06 0.00 -0.06 0.00 0.00 57.16 58.67 1ce8 n GLU 951 Cb 0.55 -2.12 0.54 0.00 -0.06 0.00 0.00 31.44 30.34 1ce8 n GLU 951 CO 0.00 0.00 0.00 0.78 -0.06 0.00 0.00 177.13 177.85 1ce8 h GLY 952 N 0.00 0.23 1.30 8.31 0.00 -2.00 -2.05 103.07 108.86 1ce8 h GLY 952 Ca 0.24 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.48 1ce8 h GLY 952 CO -0.91 0.09 -0.42 1.22 0.00 0.00 0.00 176.54 176.52 1ce8 n ASP 953 N -4.49 0.50 0.18 0.19 8.00 0.07 -3.97 116.55 117.03 1ce8 n ASP 953 Ca -0.01 0.06 0.17 0.00 0.71 0.00 0.00 54.79 55.73 1ce8 n ASP 953 Cb 0.10 0.02 0.80 0.00 -0.02 0.00 0.00 41.12 42.01 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 0.00 0.00 0.20 -1.24 1.57 -0.44 -1.30 116.57 115.37 1ce8 h LYS 954 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1ce8 h LYS 954 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.91 1ce8 h LYS 954 CO 0.00 0.00 -0.10 1.49 -0.57 0.00 0.00 179.45 180.27 1ce8 h GLU 955 N 0.00 -0.26 -0.24 3.15 4.81 -1.74 -3.35 114.58 116.94 1ce8 h GLU 955 Ca 0.11 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.32 1ce8 h GLU 955 Cb 0.58 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.00 1ce8 h GLU 955 CO -0.00 0.06 -0.04 0.00 -0.73 0.00 0.00 179.01 178.30 1ce8 h ARG 956 N -0.97 0.36 -0.71 1.92 3.08 -1.78 -3.15 114.38 113.14 1ce8 h ARG 956 Ca -0.03 -0.07 0.21 0.00 0.07 0.00 0.00 59.98 60.16 1ce8 h ARG 956 Cb 0.45 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 1ce8 h ARG 956 CO 0.05 0.42 0.59 -0.24 -1.07 0.00 0.00 179.97 179.72 1ce8 h VAL 957 N 0.35 0.45 0.05 2.04 3.04 -1.38 -1.76 116.25 119.04 1ce8 h VAL 957 Ca 0.08 0.00 0.03 0.00 -1.01 0.00 0.00 66.70 65.79 1ce8 h VAL 957 Cb 0.30 0.56 -0.04 0.00 -2.01 0.00 0.00 31.29 30.10 1ce8 h VAL 957 CO 0.01 0.00 -0.27 0.58 -1.01 0.00 0.00 177.57 176.88 1ce8 h VAL 958 N 0.00 0.40 -0.54 1.51 2.07 -1.74 0.25 116.25 118.20 1ce8 h VAL 958 Ca 0.34 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.86 1ce8 h VAL 958 Cb 1.52 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 1ce8 h VAL 958 CO -0.00 0.00 0.34 -0.78 0.02 0.00 0.00 177.57 177.14 1ce8 h ASP 959 N -0.44 0.63 -0.52 0.57 3.58 -1.57 0.94 116.42 119.61 1ce8 h ASP 959 Ca 0.05 -0.02 -0.04 0.00 0.42 0.00 0.00 57.03 57.44 1ce8 h ASP 959 Cb 0.50 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.37 1ce8 h ASP 959 CO -0.20 0.47 0.17 0.25 -2.88 0.00 0.00 179.24 177.05 1ce8 h LEU 960 N 0.73 0.75 -0.59 2.28 5.85 -1.29 0.22 115.31 123.26 1ce8 h LEU 960 Ca 0.20 -0.20 0.06 0.00 0.84 0.00 0.00 57.88 58.77 1ce8 h LEU 960 Cb -0.05 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 40.73 1ce8 h LEU 960 CO -0.04 0.75 0.30 0.00 -0.34 0.00 0.00 178.44 179.11 1ce8 h ALA 961 N 1.03 0.77 -0.27 1.25 0.00 0.11 -1.30 119.26 120.86 1ce8 h ALA 961 Ca 0.17 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1ce8 h ALA 961 Cb 0.26 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1ce8 h ALA 961 CO -0.01 -0.05 0.18 0.00 0.00 0.00 0.00 179.25 179.37 1ce8 h ALA 962 N 1.33 0.34 -0.47 0.00 0.00 -0.30 -0.80 119.26 119.36 1ce8 h ALA 962 Ca 0.27 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.23 1ce8 h ALA 962 Cb 0.19 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 1ce8 h ALA 962 CO -0.19 -0.19 0.11 0.87 0.00 0.00 0.00 179.25 179.85 1ce8 h LYS 963 N 0.36 0.25 -0.58 0.00 1.57 0.30 -0.55 116.57 117.93 1ce8 h LYS 963 Ca 0.10 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.83 1ce8 h LYS 963 Cb -0.04 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.18 1ce8 h LYS 963 CO -0.02 0.17 0.23 -0.07 -0.57 0.00 0.00 179.45 179.18 1ce8 h LEU 964 N 0.26 0.76 0.15 2.94 3.38 -0.94 -1.28 115.31 120.57 1ce8 h LEU 964 Ca 0.23 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 1ce8 h LEU 964 Cb 0.28 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1ce8 h LEU 964 CO -0.28 0.68 -0.07 -0.07 0.09 0.00 0.00 178.44 178.79 1ce8 h LEU 965 N 0.82 -0.17 -1.07 1.67 3.38 -0.05 0.49 115.31 120.39 1ce8 h LEU 965 Ca 0.20 -0.15 0.22 0.00 0.09 0.00 0.00 57.88 58.23 1ce8 h LEU 965 Cb 0.16 0.04 -0.11 0.00 0.09 0.00 0.00 40.66 40.85 1ce8 h LEU 965 CO -0.02 0.06 0.61 0.50 0.09 0.00 0.00 178.44 179.68 1ce8 h LYS 966 N -0.39 0.63 0.00 1.13 3.64 -0.71 0.71 116.57 121.58 1ce8 h LYS 966 Ca -0.02 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1ce8 h LYS 966 Cb 0.31 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1ce8 h LYS 966 CO 0.03 0.42 0.00 1.04 -2.27 0.00 0.00 179.45 178.67 1ce8 n GLN 967 N -4.78 0.92 -0.66 1.90 1.13 -0.52 -4.88 117.38 110.49 1ce8 n GLN 967 Ca 0.25 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.31 1ce8 n GLN 967 Cb 0.66 -1.43 0.00 0.00 0.11 0.00 0.00 30.24 29.59 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 0.77 0.62 3.85 1.08 0.00 0.25 -4.83 105.19 106.93 1ce8 n GLY 968 Ca 0.19 -0.49 -0.32 0.00 0.00 0.00 0.00 46.02 45.40 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 3.41 0.30 1.61 0.40 0.12 -4.47 117.98 117.35 1ce8 s PHE 969 Ca 0.00 1.24 0.03 0.00 -0.60 0.00 0.00 56.93 57.59 1ce8 s PHE 969 Cb 0.00 -2.57 -0.03 0.00 0.51 0.00 0.00 43.02 40.93 1ce8 s PHE 969 CO 0.00 -0.05 0.46 -1.21 0.70 0.00 0.00 175.22 175.12 1ce8 s GLU 970 N -3.43 3.46 0.10 0.44 2.02 0.16 -4.40 118.70 117.05 1ce8 s GLU 970 Ca 0.55 -0.53 0.10 0.00 0.02 0.00 0.00 54.97 55.10 1ce8 s GLU 970 Cb -0.10 -2.77 -0.04 0.00 0.10 0.00 0.00 34.13 31.33 1ce8 s GLU 970 CO 0.23 0.27 -0.25 -0.51 0.02 0.00 0.00 175.26 175.02 1ce8 s LEU 971 N -4.17 2.27 0.03 1.80 1.43 -1.26 -1.36 118.68 117.42 1ce8 s LEU 971 Ca 0.37 -0.68 0.03 0.00 -1.03 0.00 0.00 54.13 52.82 1ce8 s LEU 971 Cb -0.09 -1.16 -0.02 0.00 0.03 0.00 0.00 46.19 44.95 1ce8 s LEU 971 CO 0.33 0.18 -0.09 -1.81 0.23 0.00 0.00 176.35 175.19 1ce8 s ASP 972 N -1.78 1.00 0.11 2.29 1.11 0.04 -1.15 116.67 118.29 1ce8 s ASP 972 Ca 0.12 -0.38 -0.16 0.00 0.18 0.00 0.00 52.55 52.31 1ce8 s ASP 972 Cb -0.10 -0.04 0.04 0.00 1.07 0.00 0.00 42.92 43.89 1ce8 s ASP 972 CO 0.04 -0.05 0.40 0.00 1.18 0.00 0.00 175.17 176.75 1ce8 s ALA 973 N -0.82 -0.95 0.45 5.23 0.00 -0.59 -0.42 121.76 124.66 1ce8 s ALA 973 Ca -0.03 0.03 -0.10 0.00 0.00 0.00 0.00 51.96 51.85 1ce8 s ALA 973 Cb -0.07 0.62 -0.06 0.00 0.00 0.00 0.00 23.12 23.61 1ce8 s ALA 973 CO 0.00 -0.60 0.82 0.95 0.00 0.00 0.00 175.76 176.94 1ce8 s THR 974 N -3.53 4.77 0.00 0.00 -4.23 -0.92 -2.27 115.64 109.46 1ce8 s THR 974 Ca 0.01 0.65 0.00 0.00 -1.18 0.00 0.00 61.69 61.17 1ce8 s THR 974 Cb 0.01 -3.77 0.00 0.00 1.34 0.00 0.00 72.50 70.09 1ce8 s THR 974 CO -0.10 -0.66 0.24 1.57 -0.54 0.00 0.00 174.62 175.13 1ce8 n HIS 975 N -1.64 0.00 -0.28 3.99 -0.00 -1.26 0.44 115.22 116.46 1ce8 n HIS 975 Ca 0.03 0.00 -0.05 0.00 0.46 0.00 0.00 57.72 58.16 1ce8 n HIS 975 Cb 0.54 -0.12 0.06 0.00 -0.12 0.00 0.00 29.99 30.36 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 1.18 0.97 1.57 0.00 -1.97 -1.44 103.07 103.39 1ce8 h GLY 976 Ca 0.00 -0.57 -0.04 0.00 0.00 0.00 0.00 47.33 46.72 1ce8 h GLY 976 CO 0.00 0.54 0.13 -0.84 0.00 0.00 0.00 176.54 176.37 1ce8 h THR 977 N 1.09 1.24 0.00 4.70 2.02 -1.44 -1.77 112.91 118.74 1ce8 h THR 977 Ca 0.27 -0.81 -0.04 0.00 0.77 0.00 0.00 66.41 66.60 1ce8 h THR 977 Cb 0.08 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1ce8 h THR 977 CO -0.04 0.29 -0.19 0.00 0.37 0.00 0.00 175.52 175.96 1ce8 h ALA 978 N 0.99 1.34 0.28 6.16 0.00 0.37 -1.92 119.26 126.48 1ce8 h ALA 978 Ca 0.15 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1ce8 h ALA 978 Cb 0.31 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1ce8 h ALA 978 CO -0.00 0.23 -0.13 0.82 0.00 0.00 0.00 179.25 180.17 1ce8 h ILE 979 N 0.00 0.75 -0.45 0.00 1.08 -0.36 -1.29 117.51 117.23 1ce8 h ILE 979 Ca -0.00 -0.19 -0.02 0.00 -0.39 0.00 0.00 64.86 64.26 1ce8 h ILE 979 Cb 0.43 0.86 -0.02 0.00 -3.07 0.00 0.00 36.82 35.02 1ce8 h ILE 979 CO 0.02 0.04 0.19 0.58 -0.69 0.00 0.00 178.15 178.30 1ce8 h VAL 980 N -0.47 1.17 -0.32 1.67 2.07 -1.32 -1.26 116.25 117.78 1ce8 h VAL 980 Ca -0.04 -0.50 -0.10 0.00 0.82 0.00 0.00 66.70 66.88 1ce8 h VAL 980 Cb 0.36 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1ce8 h VAL 980 CO 0.06 0.20 -0.18 -0.07 0.02 0.00 0.00 177.57 177.61 1ce8 h LEU 981 N 0.64 0.71 -0.38 2.57 3.38 -1.22 -2.82 115.31 118.17 1ce8 h LEU 981 Ca 0.16 -0.42 0.05 0.00 0.09 0.00 0.00 57.88 57.76 1ce8 h LEU 981 Cb 0.11 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.62 1ce8 h LEU 981 CO -0.02 0.97 0.12 1.23 0.09 0.00 0.00 178.44 180.83 1ce8 h GLY 982 N 0.45 0.48 2.00 0.83 0.00 0.15 0.19 103.07 107.16 1ce8 h GLY 982 Ca 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1ce8 h GLY 982 CO 0.05 0.01 0.00 1.18 0.00 0.00 0.00 176.54 177.78 1ce8 n GLU 983 N -5.04 0.14 -0.04 4.80 -0.58 -0.52 -1.37 120.64 118.03 1ce8 n GLU 983 Ca 0.02 0.54 0.08 0.00 -0.42 0.00 0.00 57.16 57.38 1ce8 n GLU 983 Cb 0.15 -1.86 0.09 0.00 -0.57 0.00 0.00 31.44 29.25 1ce8 n GLU 983 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ce8 n ALA 984 N -1.73 2.44 0.00 0.62 0.00 0.41 -4.94 120.51 117.30 1ce8 n ALA 984 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 53.44 52.73 1ce8 n ALA 984 Cb 0.10 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 18.99 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 0.92 0.91 3.27 0.00 0.00 -0.47 -5.08 105.19 104.74 1ce8 n GLY 985 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.00 2.72 -0.68 -0.61 1.01 0.22 -4.98 121.20 116.87 1ce8 s ILE 986 Ca 0.00 -0.75 -0.02 0.00 0.00 0.00 0.00 60.65 59.88 1ce8 s ILE 986 Cb 0.00 -2.15 0.17 0.00 0.01 0.00 0.00 42.46 40.49 1ce8 s ILE 986 CO 0.00 0.51 0.51 0.20 0.00 0.00 0.00 174.94 176.16 1ce8 s ASN 987 N 0.85 5.34 0.90 3.58 0.02 -1.26 -1.00 114.94 123.37 1ce8 s ASN 987 Ca -0.04 -3.07 -0.12 0.00 -1.02 0.00 0.00 52.86 48.60 1ce8 s ASN 987 Cb -0.15 -1.85 0.13 0.00 0.02 0.00 0.00 41.25 39.40 1ce8 s ASN 987 CO -0.00 -0.32 1.13 -2.16 0.02 0.00 0.00 177.10 175.76 1ce8 s PRO 988 N -0.38 1.22 0.02 -0.60 0.04 -1.26 -4.95 135.00 129.09 1ce8 s PRO 988 Ca 0.19 0.37 -0.26 0.00 0.04 0.00 0.00 61.00 61.34 1ce8 s PRO 988 Cb -0.17 -1.84 -0.05 0.00 0.04 0.00 0.00 34.50 32.48 1ce8 s PRO 988 CO -0.05 -2.16 0.81 0.50 0.04 0.00 0.00 177.00 176.14 1ce8 s ARG 989 N -5.23 4.52 0.17 4.56 3.52 -0.30 -4.88 118.95 121.32 1ce8 s ARG 989 Ca 0.63 1.13 -0.27 0.00 -0.13 0.00 0.00 55.73 57.09 1ce8 s ARG 989 Cb -0.15 -3.40 -0.08 0.00 -1.56 0.00 0.00 34.95 29.76 1ce8 s ARG 989 CO 0.54 0.18 0.84 -1.17 -0.81 0.00 0.00 175.30 174.88 1ce8 s LEU 990 N 0.29 4.59 0.13 -0.88 2.96 -1.26 -1.54 118.68 122.96 1ce8 s LEU 990 Ca 0.41 1.74 0.09 0.00 -0.22 0.00 0.00 54.13 56.15 1ce8 s LEU 990 Cb -0.20 -3.41 -0.04 0.00 0.50 0.00 0.00 46.19 43.04 1ce8 s LEU 990 CO 0.24 0.16 -0.21 0.54 -1.32 0.00 0.00 176.35 175.76 1ce8 s VAL 991 N -0.97 1.82 0.15 1.68 0.11 -0.96 -4.91 120.40 117.31 1ce8 s VAL 991 Ca 0.38 -1.71 -0.12 0.00 -2.93 0.00 0.00 61.98 57.60 1ce8 s VAL 991 Cb -0.24 -1.71 -0.07 0.00 -1.53 0.00 0.00 36.38 32.83 1ce8 s VAL 991 CO 0.28 -0.14 0.52 0.20 -3.33 0.00 0.00 175.10 172.63 1ce8 s ASN 992 N -2.21 6.75 0.94 3.54 0.02 -1.20 -4.41 114.94 118.37 1ce8 s ASN 992 Ca 0.11 0.98 -0.12 0.00 -1.02 0.00 0.00 52.86 52.81 1ce8 s ASN 992 Cb -0.08 -2.25 0.15 0.00 0.02 0.00 0.00 41.25 39.09 1ce8 s ASN 992 CO 0.05 0.08 1.11 -0.54 0.02 0.00 0.00 177.10 177.83 1ce8 s LYS 993 N -2.13 0.91 0.26 -0.60 1.02 -1.26 -1.50 119.74 116.44 1ce8 s LYS 993 Ca 0.39 0.43 -0.05 0.00 0.02 0.00 0.00 55.97 56.76 1ce8 s LYS 993 Cb -0.14 -1.80 0.32 0.00 -0.52 0.00 0.00 37.83 35.69 1ce8 s LYS 993 CO 0.19 -2.38 1.91 0.28 -0.92 0.00 0.00 175.35 174.43 1ce8 h VAL 994 N -1.64 1.20 0.00 3.17 2.07 -1.95 -1.68 116.25 117.42 1ce8 h VAL 994 Ca -0.52 -0.45 0.00 0.00 0.82 0.00 0.00 66.70 66.56 1ce8 h VAL 994 Cb 1.32 -0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 1ce8 h VAL 994 CO 0.60 0.24 0.00 1.12 0.02 0.00 0.00 177.57 179.54 1ce8 h HIS 995 N 1.30 0.00 0.00 1.57 2.07 -1.98 -3.22 115.15 114.89 1ce8 h HIS 995 Ca 0.39 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.91 1ce8 h HIS 995 Cb -0.04 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.94 1ce8 h HIS 995 CO -0.00 0.00 -0.24 0.39 -3.07 0.00 0.00 177.93 175.01 1ce8 n GLU 996 N -2.58 0.13 0.00 5.12 1.02 -0.64 -5.05 120.64 118.64 1ce8 n GLU 996 Ca 0.03 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 1ce8 n GLU 996 Cb 0.33 -1.62 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 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 1.42 0.47 3.90 0.62 0.00 -1.22 -4.88 105.19 105.49 1ce8 n GLY 997 Ca 0.06 -2.19 -0.25 0.00 0.00 0.00 0.00 46.02 43.63 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 -0.62 3.26 0.68 1.61 0.52 -1.26 -3.17 118.95 119.96 1ce8 s ARG 998 Ca 0.00 -0.73 -0.06 0.00 -0.52 0.00 0.00 55.73 54.42 1ce8 s ARG 998 Cb 0.00 -2.84 0.06 0.00 0.52 0.00 0.00 34.95 32.69 1ce8 s ARG 998 CO 0.00 0.49 0.99 -2.14 0.02 0.00 0.00 175.30 174.66 1ce8 s PRO 999 N -3.34 2.28 0.00 3.54 0.02 -1.26 -4.84 135.00 131.39 1ce8 s PRO 999 Ca 0.33 -0.28 0.00 0.00 0.02 0.00 0.00 61.00 61.08 1ce8 s PRO 999 Cb -0.10 -2.20 0.00 0.00 0.02 0.00 0.00 34.50 32.22 1ce8 s PRO 999 CO 0.27 -1.16 0.00 -2.39 -0.33 0.00 0.00 177.00 173.39 1ce8 n HIS 1000N -2.85 -1.64 -0.22 6.54 1.44 -1.19 -3.24 115.22 114.04 1ce8 n HIS 1000Ca 0.08 0.00 -0.07 0.00 -2.01 0.00 0.00 57.72 55.72 1ce8 n HIS 1000Cb 0.60 0.00 0.04 0.00 0.12 0.00 0.00 29.99 30.75 1ce8 n HIS 1000CO 0.00 0.00 0.00 -0.84 -2.81 0.00 0.00 176.34 172.69 1ce8 h ILE 1001N 0.35 1.21 -0.52 0.61 3.07 -1.55 -2.10 117.51 118.58 1ce8 h ILE 1001Ca 0.00 -0.59 0.10 0.00 1.55 0.00 0.00 64.86 65.93 1ce8 h ILE 1001Cb 0.00 0.45 -0.09 0.00 -0.27 0.00 0.00 36.82 36.90 1ce8 h ILE 1001CO 0.00 0.24 -0.06 -0.61 -1.05 0.00 0.00 178.15 176.68 1ce8 h GLN 1002N 0.86 0.06 -0.23 0.16 -0.00 -1.92 1.04 115.11 115.08 1ce8 h GLN 1002Ca 0.22 -0.00 -0.05 0.00 -0.00 0.00 0.00 58.65 58.81 1ce8 h GLN 1002Cb 0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 27.48 27.56 1ce8 h GLN 1002CO -0.03 0.04 -0.05 -0.44 0.00 0.00 0.00 178.83 178.35 1ce8 h ASP 1003N 0.06 0.44 -0.55 -0.69 3.32 -1.90 -0.42 116.42 116.69 1ce8 h ASP 1003Ca 0.26 -0.36 0.00 0.00 0.02 0.00 0.00 57.03 56.95 1ce8 h ASP 1003Cb 0.40 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.81 1ce8 h ASP 1003CO -0.48 0.70 0.36 0.03 -1.72 0.00 0.00 179.24 178.13 1ce8 h ARG 1004N 0.18 0.73 0.22 3.56 3.08 -0.62 0.43 114.38 121.96 1ce8 h ARG 1004Ca 0.06 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1ce8 h ARG 1004Cb 0.51 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1ce8 h ARG 1004CO 0.02 0.49 -0.11 0.82 -1.07 0.00 0.00 179.97 180.13 1ce8 h ILE 1005N 0.75 0.80 -0.96 2.04 2.04 0.12 -1.58 117.51 120.73 1ce8 h ILE 1005Ca 0.20 -0.12 0.16 0.00 1.00 0.00 0.00 64.86 66.10 1ce8 h ILE 1005Cb -0.08 0.88 -0.08 0.00 -0.74 0.00 0.00 36.82 36.80 1ce8 h ILE 1005CO -0.04 0.03 0.60 0.50 0.00 0.00 0.00 178.15 179.24 1ce8 h LYS 1006N -0.36 0.72 -0.81 2.37 3.64 -0.75 -1.32 116.57 120.06 1ce8 h LYS 1006Ca -0.03 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1ce8 h LYS 1006Cb 0.28 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1ce8 h LYS 1006CO 0.05 0.48 0.00 0.09 -2.27 0.00 0.00 179.45 177.80 1ce8 n ASN 1007N -4.63 3.12 -3.19 4.20 5.03 0.15 -4.89 115.26 115.05 1ce8 n ASN 1007Ca 0.20 -2.42 -0.23 0.00 0.87 0.00 0.00 54.58 53.00 1ce8 n ASN 1007Cb 0.51 -0.58 0.04 0.00 -1.02 0.00 0.00 39.78 38.72 1ce8 n ASN 1007CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ce8 n GLY 1008N 0.29 -0.52 0.22 7.41 0.00 -0.50 -4.88 105.19 107.20 1ce8 n GLY 1008Ca 0.12 0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.41 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 -1.57 0.00 -6.45 1.61 5.08 -1.50 -3.46 114.58 108.29 1ce8 h GLU 1009Ca -0.53 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.20 1ce8 h GLU 1009Cb 1.36 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.45 1ce8 h GLU 1009CO 0.57 0.05 -0.76 0.71 -1.00 0.00 0.00 179.01 178.58 1ce8 s TYR 1010N -3.27 2.46 0.00 4.33 2.02 -1.26 -4.19 117.35 117.44 1ce8 s TYR 1010Ca 0.06 -0.29 0.00 0.00 -0.37 0.00 0.00 57.07 56.47 1ce8 s TYR 1010Cb 0.06 -1.18 0.00 0.00 -0.40 0.00 0.00 41.96 40.44 1ce8 s TYR 1010CO 0.66 0.55 0.25 0.25 -1.57 0.00 0.00 175.55 175.68 1ce8 n THR 1011N -0.05 0.00 -3.64 -0.71 -2.24 -0.37 -4.92 114.28 102.34 1ce8 n THR 1011Ca -0.10 -0.43 -0.12 0.00 -2.27 0.00 0.00 64.05 61.13 1ce8 n THR 1011Cb 0.57 1.08 -0.07 0.00 -2.10 0.00 0.00 70.33 69.80 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 -0.37 -0.85 -0.08 4.78 5.04 -1.13 -3.92 117.35 120.83 1ce8 s TYR 1012Ca 0.00 1.93 -0.00 0.00 -2.44 0.00 0.00 57.07 56.56 1ce8 s TYR 1012Cb 0.00 0.37 0.02 0.00 0.35 0.00 0.00 41.96 42.71 1ce8 s TYR 1012CO 0.00 -0.41 -0.04 0.42 -1.34 0.00 0.00 175.55 174.18 1ce8 s ILE 1013N 0.77 0.66 -0.28 3.14 1.01 -0.86 -0.03 121.20 125.60 1ce8 s ILE 1013Ca -0.03 -0.09 -0.06 0.00 0.00 0.00 0.00 60.65 60.46 1ce8 s ILE 1013Cb -0.05 -0.73 0.01 0.00 0.01 0.00 0.00 42.46 41.70 1ce8 s ILE 1013CO -0.06 0.29 0.06 -0.51 0.00 0.00 0.00 174.94 174.72 1ce8 s ILE 1014N 1.57 3.83 -0.26 2.92 1.10 0.35 -1.35 121.20 129.37 1ce8 s ILE 1014Ca 0.00 -0.70 -0.02 0.00 -0.51 0.00 0.00 60.65 59.42 1ce8 s ILE 1014Cb -0.13 -2.96 0.08 0.00 0.15 0.00 0.00 42.46 39.60 1ce8 s ILE 1014CO -0.04 0.12 0.07 0.21 -2.11 0.00 0.00 174.94 173.18 1ce8 s ASN 1015N 1.48 3.56 -0.03 4.50 3.04 -0.59 -1.57 114.94 125.33 1ce8 s ASN 1015Ca 0.03 -1.28 0.02 0.00 0.04 0.00 0.00 52.86 51.67 1ce8 s ASN 1015Cb -0.17 -0.74 -0.03 0.00 -1.54 0.00 0.00 41.25 38.77 1ce8 s ASN 1015CO 0.01 -0.37 -0.05 0.42 -3.04 0.00 0.00 177.10 174.07 1ce8 s THR 1016N 1.74 3.78 0.02 -5.21 -4.23 -0.74 -4.34 115.64 106.66 1ce8 s THR 1016Ca 0.05 -0.62 -0.10 0.00 -1.18 0.00 0.00 61.69 59.84 1ce8 s THR 1016Cb -0.17 -2.61 0.01 0.00 1.34 0.00 0.00 72.50 71.07 1ce8 s THR 1016CO -0.19 0.47 0.21 -0.89 -0.54 0.00 0.00 174.62 173.69 1ce8 s THR 1017N -0.94 0.09 0.04 3.99 2.01 -1.26 -1.38 115.64 118.19 1ce8 s THR 1017Ca 0.16 -0.72 0.03 0.00 0.31 0.00 0.00 61.69 61.47 1ce8 s THR 1017Cb -0.11 -0.69 -0.02 0.00 0.01 0.00 0.00 72.50 71.69 1ce8 s THR 1017CO 0.05 -0.39 -0.09 -0.55 -0.69 0.00 0.00 174.62 172.95 1ce8 s SER 1018N -1.68 1.04 0.07 3.53 0.15 -1.26 -4.97 113.70 110.58 1ce8 s SER 1018Ca -0.10 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.05 1ce8 s SER 1018Cb -0.04 -0.00 0.00 0.00 -1.71 0.00 0.00 66.02 64.26 1ce8 s SER 1018CO -0.00 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 174.92 1ce8 n GLY 1019N 1.65 -3.18 0.44 9.45 0.00 -1.26 -4.30 105.19 107.99 1ce8 n GLY 1019Ca -0.21 -1.12 -0.13 0.00 0.00 0.00 0.00 46.02 44.56 1ce8 n GLY 1019CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1ce8 h ARG 1020N 0.20 -0.34 -0.81 1.61 9.65 -1.99 0.20 114.38 122.90 1ce8 h ARG 1020Ca 0.00 0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.89 1ce8 h ARG 1020Cb 0.01 0.08 -0.04 0.00 -1.39 0.00 0.00 29.97 28.63 1ce8 h ARG 1020CO 0.00 -0.23 0.45 0.00 2.80 0.00 0.00 179.97 183.00 1ce8 h ARG 1021N -0.35 1.12 -0.23 0.20 3.08 -1.98 0.26 114.38 116.47 1ce8 h ARG 1021Ca 0.09 -0.12 -0.15 0.00 0.07 0.00 0.00 59.98 59.87 1ce8 h ARG 1021Cb 0.58 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.41 1ce8 h ARG 1021CO -0.63 0.81 -0.44 0.00 -1.07 0.00 0.00 179.97 178.64 1ce8 h ALA 1022N 1.37 0.37 -0.04 0.04 0.00 -1.68 -0.74 119.26 118.58 1ce8 h ALA 1022Ca 0.29 -0.47 0.02 0.00 0.00 0.00 0.00 54.91 54.74 1ce8 h ALA 1022Cb 0.01 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1ce8 h ALA 1022CO -0.05 0.50 -0.06 0.82 0.00 0.00 0.00 179.25 180.47 1ce8 h ILE 1023N 0.43 0.83 -0.93 0.00 2.04 -0.10 -1.39 117.51 118.39 1ce8 h ILE 1023Ca 0.01 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.99 1ce8 h ILE 1023Cb 1.04 0.83 -0.07 0.00 -0.74 0.00 0.00 36.82 37.88 1ce8 h ILE 1023CO 0.10 0.00 0.60 -0.33 0.00 0.00 0.00 178.15 178.52 1ce8 h GLU 1024N -0.08 0.83 0.00 2.37 5.08 -0.37 -1.31 114.58 121.10 1ce8 h GLU 1024Ca 0.04 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1ce8 h GLU 1024Cb 0.14 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.20 1ce8 h GLU 1024CO -0.09 0.55 -0.07 -0.44 -1.00 0.00 0.00 179.01 177.95 1ce8 h ASP 1025N 0.86 0.00 0.18 1.42 3.32 -0.64 -3.30 116.42 118.26 1ce8 h ASP 1025Ca 0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.51 1ce8 h ASP 1025Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1ce8 h ASP 1025CO -0.22 0.07 -0.75 -1.54 -1.72 0.00 0.00 179.24 175.08 1ce8 n SER 1026N -3.13 0.91 -0.22 6.45 3.41 -0.55 -4.56 113.62 115.92 1ce8 n SER 1026Ca 0.03 -0.78 0.20 0.00 -0.26 0.00 0.00 58.87 58.07 1ce8 n SER 1026Cb 0.53 0.66 0.38 0.00 -0.26 0.00 0.00 64.21 65.52 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 -1.34 -0.04 -0.18 4.33 0.63 -0.84 -1.30 116.66 117.92 1ce8 n ARG 1027Ca 0.05 0.96 -0.01 0.00 -0.92 0.00 0.00 57.85 57.94 1ce8 n ARG 1027Cb 0.34 -1.70 0.08 0.00 0.45 0.00 0.00 32.46 31.63 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 0.59 -0.23 5.15 3.04 -1.88 0.78 116.25 123.71 1ce8 h VAL 1028Ca 0.56 -0.05 -0.07 0.00 -1.01 0.00 0.00 66.70 66.13 1ce8 h VAL 1028Cb 1.45 0.43 -0.01 0.00 -2.01 0.00 0.00 31.29 31.15 1ce8 h VAL 1028CO -0.55 0.03 -0.17 -0.29 -1.01 0.00 0.00 177.57 175.58 1ce8 h ILE 1029N 0.15 1.23 -0.01 3.17 2.10 -1.56 -0.45 117.51 122.14 1ce8 h ILE 1029Ca 0.28 -1.03 -0.21 0.00 1.08 0.00 0.00 64.86 64.98 1ce8 h ILE 1029Cb 0.43 1.24 0.02 0.00 -1.09 0.00 0.00 36.82 37.41 1ce8 h ILE 1029CO -0.44 0.33 -0.82 0.03 -1.08 0.00 0.00 178.15 176.17 1ce8 h ARG 1030N 0.36 0.57 -0.17 2.19 3.08 -1.39 -1.17 114.38 117.86 1ce8 h ARG 1030Ca 0.07 -0.60 -0.10 0.00 0.07 0.00 0.00 59.98 59.42 1ce8 h ARG 1030Cb 0.51 0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.71 1ce8 h ARG 1030CO 0.03 1.22 -0.31 0.00 -1.07 0.00 0.00 179.97 179.84 1ce8 h ARG 1031N 0.16 0.34 -0.24 0.04 3.08 -0.82 -2.21 114.38 114.73 1ce8 h ARG 1031Ca -0.10 -0.13 -0.06 0.00 0.07 0.00 0.00 59.98 59.75 1ce8 h ARG 1031Cb 1.50 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.53 1ce8 h ARG 1031CO 0.16 0.62 -0.10 0.77 -1.07 0.00 0.00 179.97 180.35 1ce8 h SER 1032N 0.29 0.50 -0.32 7.04 0.02 -1.03 -1.25 113.55 118.82 1ce8 h SER 1032Ca 0.04 -0.40 0.02 0.00 -0.84 0.00 0.00 61.79 60.61 1ce8 h SER 1032Cb 0.70 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.08 1ce8 h SER 1032CO 0.05 0.79 0.16 0.00 -1.14 0.00 0.00 176.83 176.69 1ce8 h ALA 1033N 0.73 0.38 0.07 3.77 0.00 -1.04 -1.04 119.26 122.14 1ce8 h ALA 1033Ca 0.05 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ce8 h ALA 1033Cb 0.59 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1ce8 h ALA 1033CO 0.03 -0.22 -0.03 1.25 0.00 0.00 0.00 179.25 180.28 1ce8 h LEU 1034N 0.33 -0.08 -1.55 0.00 5.85 -1.37 -0.61 115.31 117.88 1ce8 h LEU 1034Ca 0.13 -0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.83 1ce8 h LEU 1034Cb 0.04 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 1ce8 h LEU 1034CO -0.09 0.03 0.38 -0.61 -0.34 0.00 0.00 178.44 177.82 1ce8 h GLN 1035N -0.18 0.53 -0.57 1.25 4.15 -1.04 -1.79 115.11 117.46 1ce8 h GLN 1035Ca -0.01 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.38 1ce8 h GLN 1035Cb 0.15 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.72 1ce8 h GLN 1035CO 0.02 0.35 0.00 0.66 -1.93 0.00 0.00 178.83 177.93 1ce8 n TYR 1036N -4.47 0.76 -2.42 3.99 4.01 -0.41 -4.95 117.16 113.66 1ce8 n TYR 1036Ca 0.08 -0.38 -0.19 0.00 -0.16 0.00 0.00 57.90 57.25 1ce8 n TYR 1036Cb 0.24 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.27 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 1.21 -1.81 -3.39 -0.72 4.76 -0.67 -4.99 118.16 112.55 1ce8 n LYS 1037Ca 0.20 0.89 -0.38 0.00 -2.87 0.00 0.00 58.31 56.15 1ce8 n LYS 1037Cb 0.50 -5.44 -0.06 0.00 -1.84 0.00 0.00 35.03 28.18 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 -2.95 5.07 0.14 -0.18 1.01 -0.31 -4.76 120.40 118.42 1ce8 s VAL 1038Ca 0.03 0.92 -0.31 0.00 0.00 0.00 0.00 61.98 62.63 1ce8 s VAL 1038Cb -0.01 -3.78 -0.08 0.00 0.00 0.00 0.00 36.38 32.51 1ce8 s VAL 1038CO 0.04 0.46 1.37 -2.28 0.00 0.00 0.00 175.10 174.68 1ce8 s HIS 1039N -0.27 3.25 0.03 5.22 2.46 -1.26 -4.57 115.29 120.15 1ce8 s HIS 1039Ca 0.25 1.02 0.02 0.00 0.47 0.00 0.00 55.06 56.82 1ce8 s HIS 1039Cb -0.16 -3.66 -0.02 0.00 -0.13 0.00 0.00 32.58 28.61 1ce8 s HIS 1039CO 0.12 -2.25 -0.07 1.52 -2.47 0.00 0.00 174.74 171.59 1ce8 s TYR 1040N 0.85 0.61 -0.06 3.88 1.13 -1.26 -2.03 117.35 120.47 1ce8 s TYR 1040Ca 0.62 -0.37 0.05 0.00 -1.41 0.00 0.00 57.07 55.96 1ce8 s TYR 1040Cb -0.37 -0.37 -0.02 0.00 -1.10 0.00 0.00 41.96 40.10 1ce8 s TYR 1040CO 0.32 -0.06 -0.19 -0.51 -2.51 0.00 0.00 175.55 172.60 1ce8 s ASP 1041N -1.12 3.57 0.00 -0.18 1.01 -0.46 -5.00 116.67 114.49 1ce8 s ASP 1041Ca -0.06 -0.36 0.15 0.00 0.71 0.00 0.00 52.55 52.98 1ce8 s ASP 1041Cb -0.07 -0.89 0.41 0.00 1.01 0.00 0.00 42.92 43.38 1ce8 s ASP 1041CO 0.00 0.28 1.34 0.35 0.21 0.00 0.00 175.17 177.36 1ce8 n THR 1042N 2.72 0.98 -4.23 -1.27 -2.24 -1.26 -1.55 114.28 107.44 1ce8 n THR 1042Ca -0.17 -0.99 -0.19 0.00 -2.27 0.00 0.00 64.05 60.43 1ce8 n THR 1042Cb 0.52 0.51 -0.12 0.00 -2.10 0.00 0.00 70.33 69.14 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 -1.00 1.09 0.07 4.28 -4.23 -1.26 -4.58 115.64 110.00 1ce8 s THR 1043Ca 0.31 -1.18 -0.15 0.00 -1.18 0.00 0.00 61.69 59.49 1ce8 s THR 1043Cb 0.16 -1.03 -0.22 0.00 1.34 0.00 0.00 72.50 72.75 1ce8 s THR 1043CO 0.21 -0.15 1.19 0.25 -0.54 0.00 0.00 174.62 175.59 1ce8 h LEU 1044N 4.53 0.87 -0.70 4.79 5.85 -1.95 -1.20 115.31 127.50 1ce8 h LEU 1044Ca -0.40 -0.73 0.08 0.00 0.84 0.00 0.00 57.88 57.67 1ce8 h LEU 1044Cb 1.19 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 41.89 1ce8 h LEU 1044CO 0.41 1.48 0.37 0.78 -0.34 0.00 0.00 178.44 181.15 1ce8 h ASN 1045N 0.35 0.53 -0.50 1.25 4.21 -1.97 0.13 115.58 119.58 1ce8 h ASN 1045Ca -0.11 0.04 -0.07 0.00 1.21 0.00 0.00 56.30 57.37 1ce8 h ASN 1045Cb 1.61 -0.05 -0.02 0.00 -1.12 0.00 0.00 38.32 38.73 1ce8 h ASN 1045CO 0.19 0.32 0.05 1.23 -1.29 0.00 0.00 177.43 177.93 1ce8 h GLY 1046N 0.66 0.97 1.01 2.83 0.00 -1.80 -2.08 103.07 104.65 1ce8 h GLY 1046Ca 0.33 -0.64 0.00 0.00 0.00 0.00 0.00 47.33 47.02 1ce8 h GLY 1046CO -0.22 0.59 0.44 -1.33 0.00 0.00 0.00 176.54 176.02 1ce8 h GLY 1047N 1.00 0.97 0.91 4.60 0.00 0.43 -0.98 103.07 110.01 1ce8 h GLY 1047Ca 0.17 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 1ce8 h GLY 1047CO 0.01 0.37 0.10 0.74 0.00 0.00 0.00 176.54 177.76 1ce8 h PHE 1048N 0.93 0.50 -0.90 5.60 0.04 -0.70 -1.62 116.94 120.79 1ce8 h PHE 1048Ca 0.25 -0.05 0.06 0.00 2.80 0.00 0.00 57.97 61.03 1ce8 h PHE 1048Cb -0.08 -0.15 -0.06 0.00 2.20 0.00 0.00 35.95 37.86 1ce8 h PHE 1048CO -0.02 0.51 0.57 0.00 -0.60 0.00 0.00 178.31 178.77 1ce8 h ALA 1049N 0.93 1.24 -0.23 2.45 0.00 -0.99 -0.72 119.26 121.95 1ce8 h ALA 1049Ca 0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1ce8 h ALA 1049Cb 0.25 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ce8 h ALA 1049CO -0.00 0.33 0.12 1.15 0.00 0.00 0.00 179.25 180.85 1ce8 h THR 1050N 1.04 1.13 -0.88 0.00 2.02 -0.99 -2.25 112.91 112.99 1ce8 h THR 1050Ca 0.39 -0.38 0.11 0.00 0.77 0.00 0.00 66.41 67.30 1ce8 h THR 1050Cb 0.16 0.96 -0.08 0.00 -1.74 0.00 0.00 68.15 67.45 1ce8 h THR 1050CO -0.17 0.13 0.51 0.00 0.37 0.00 0.00 175.52 176.36 1ce8 h ALA 1051N 0.98 1.29 -0.10 6.16 0.00 -0.44 -1.72 119.26 125.42 1ce8 h ALA 1051Ca 0.08 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1ce8 h ALA 1051Cb 0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1ce8 h ALA 1051CO -0.01 0.10 -0.34 0.52 0.00 0.00 0.00 179.25 179.52 1ce8 h MET 1052N 0.82 0.21 0.00 0.00 2.86 -0.89 -2.54 114.93 115.38 1ce8 h MET 1052Ca 0.44 -0.08 0.00 0.00 -2.06 0.00 0.00 59.70 57.99 1ce8 h MET 1052Cb 0.45 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.10 1ce8 h MET 1052CO -0.27 0.53 0.00 0.00 1.06 0.00 0.00 176.91 178.23 1ce8 n ALA 1053N -2.48 2.08 0.31 6.32 0.00 -0.66 -2.82 120.51 123.27 1ce8 n ALA 1053Ca -0.01 -0.09 0.15 0.00 0.00 0.00 0.00 53.44 53.50 1ce8 n ALA 1053Cb 0.42 -1.38 0.57 0.00 0.00 0.00 0.00 19.45 19.06 1ce8 n ALA 1053CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1ce8 h LEU 1054N 0.00 0.00 -1.74 0.00 3.38 -1.27 -2.38 115.31 113.30 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 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 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 -2.89 2.60 -4.42 -0.43 5.03 -1.13 -4.93 115.26 109.10 1ce8 n ASN 1055Ca 0.02 -1.87 -0.21 0.00 0.87 0.00 0.00 54.58 53.38 1ce8 n ASN 1055Cb 0.33 -0.19 -0.10 0.00 -1.02 0.00 0.00 39.78 38.79 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 -1.62 2.40 -0.27 5.41 0.00 -0.90 -5.02 121.76 121.77 1ce8 s ALA 1056Ca 0.35 -1.84 0.01 0.00 0.00 0.00 0.00 51.96 50.48 1ce8 s ALA 1056Cb 0.20 -0.03 0.08 0.00 0.00 0.00 0.00 23.12 23.36 1ce8 s ALA 1056CO 0.28 0.07 0.00 0.34 0.00 0.00 0.00 175.76 176.46 1ce8 s ASP 1057N -3.44 4.01 0.38 0.00 2.15 -1.26 -4.99 116.67 113.53 1ce8 s ASP 1057Ca 0.28 -1.44 0.28 0.00 0.43 0.00 0.00 52.55 52.09 1ce8 s ASP 1057Cb 0.00 -1.16 1.29 0.00 -0.30 0.00 0.00 42.92 42.74 1ce8 s ASP 1057CO 0.11 -0.31 1.83 0.00 -0.17 0.00 0.00 175.17 176.64 1ce8 h ALA 1058N 7.93 1.00 -0.03 3.66 0.00 -1.89 -1.97 119.26 127.96 1ce8 h ALA 1058Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1ce8 h ALA 1058Cb 1.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1ce8 h ALA 1058CO 0.44 0.00 -0.07 0.25 0.00 0.00 0.00 179.25 179.87 1ce8 n THR 1059N -2.51 0.00 0.10 0.00 -2.24 -1.26 -4.62 114.28 103.75 1ce8 n THR 1059Ca 0.00 -0.46 -0.04 0.00 -2.27 0.00 0.00 64.05 61.28 1ce8 n THR 1059Cb 0.17 1.44 -0.02 0.00 -2.10 0.00 0.00 70.33 69.82 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 4.16 -0.25 -5.88 -0.78 4.81 -1.75 -3.46 114.58 111.44 1ce8 h GLU 1060Ca 0.00 0.02 -0.52 0.00 -0.13 0.00 0.00 59.36 58.73 1ce8 h GLU 1060Cb 0.92 0.06 -0.23 0.00 0.63 0.00 0.00 28.75 30.13 1ce8 h GLU 1060CO 0.00 -0.17 -0.81 0.21 -0.73 0.00 0.00 179.01 177.51 1ce8 s LYS 1061N -3.59 1.08 0.08 1.92 2.20 -1.26 -5.10 119.74 115.07 1ce8 s LYS 1061Ca -0.04 -1.03 0.09 0.00 -0.36 0.00 0.00 55.97 54.63 1ce8 s LYS 1061Cb 0.01 -1.23 -0.03 0.00 -1.51 0.00 0.00 37.83 35.06 1ce8 s LYS 1061CO 0.12 0.29 -0.23 0.14 -0.36 0.00 0.00 175.35 175.31 1ce8 s VAL 1062N -1.09 1.90 -0.01 4.02 -7.23 -1.26 -5.02 120.40 111.71 1ce8 s VAL 1062Ca 0.04 -1.48 -0.01 0.00 -1.81 0.00 0.00 61.98 58.72 1ce8 s VAL 1062Cb -0.10 -1.68 0.00 0.00 0.56 0.00 0.00 36.38 35.17 1ce8 s VAL 1062CO 0.03 0.11 0.03 -0.51 -0.31 0.00 0.00 175.10 174.45 1ce8 s ILE 1063N -0.99 -0.00 0.43 -0.62 2.07 -1.26 -5.10 121.20 115.73 1ce8 s ILE 1063Ca 0.09 0.02 -0.07 0.00 -1.41 0.00 0.00 60.65 59.28 1ce8 s ILE 1063Cb -0.10 -0.05 -0.05 0.00 0.13 0.00 0.00 42.46 42.39 1ce8 s ILE 1063CO 0.04 0.01 0.76 -0.94 -1.91 0.00 0.00 174.94 172.89 1ce8 s SER 1064N 0.11 6.38 0.16 4.50 1.04 -1.26 -4.53 113.70 120.10 1ce8 s SER 1064Ca -0.01 0.99 -0.14 0.00 0.48 0.00 0.00 55.95 57.27 1ce8 s SER 1064Cb -0.01 -2.27 0.05 0.00 0.10 0.00 0.00 66.02 63.90 1ce8 s SER 1064CO -0.00 -0.47 1.76 0.58 0.98 0.00 0.00 173.24 176.09 1ce8 h VAL 1065N 0.67 1.19 -0.51 5.02 2.07 -1.40 0.50 116.25 123.79 1ce8 h VAL 1065Ca -0.47 -0.50 0.06 0.00 0.82 0.00 0.00 66.70 66.61 1ce8 h VAL 1065Cb 1.20 0.55 -0.05 0.00 -1.52 0.00 0.00 31.29 31.46 1ce8 h VAL 1065CO 0.63 0.20 0.23 1.56 0.02 0.00 0.00 177.57 180.21 1ce8 h GLN 1066N 0.71 0.43 -0.55 1.57 7.50 -1.91 0.34 115.11 123.19 1ce8 h GLN 1066Ca 0.18 -0.03 -0.01 0.00 0.50 0.00 0.00 58.65 59.30 1ce8 h GLN 1066Cb 0.08 -0.10 -0.03 0.00 0.05 0.00 0.00 27.48 27.48 1ce8 h GLN 1066CO -0.03 0.28 0.31 0.93 -1.50 0.00 0.00 178.83 178.83 1ce8 h GLU 1067N 0.44 0.77 0.34 1.46 5.08 -1.70 -1.89 114.58 119.08 1ce8 h GLU 1067Ca 0.23 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1ce8 h GLU 1067Cb 0.19 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 1ce8 h GLU 1067CO -0.20 0.58 -0.46 0.52 -1.00 0.00 0.00 179.01 178.46 1ce8 h MET 1068N 0.74 -0.81 -0.06 2.33 2.86 0.15 -2.62 114.93 117.52 1ce8 h MET 1068Ca 0.20 0.06 0.02 0.00 -2.06 0.00 0.00 59.70 57.91 1ce8 h MET 1068Cb 0.03 0.18 -0.00 0.00 0.06 0.00 0.00 31.60 31.88 1ce8 h MET 1068CO -0.03 -0.54 0.06 0.45 1.06 0.00 0.00 176.91 177.90 1ce8 h HIS 1069N -0.84 0.00 0.00 -0.22 3.86 -0.27 -1.30 115.15 116.37 1ce8 h HIS 1069Ca -0.03 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.07 1ce8 h HIS 1069Cb 0.78 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.23 1ce8 h HIS 1069CO -0.30 0.00 -0.52 0.00 0.86 0.00 0.00 177.93 177.97 1ce8 h ALA 1070N 1.95 0.96 0.00 2.45 0.00 -0.98 -2.60 119.26 121.04 1ce8 h ALA 1070Ca 0.03 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1ce8 h ALA 1070Cb 0.14 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1ce8 h ALA 1070CO -0.00 0.65 0.00 1.04 0.00 0.00 0.00 179.25 180.94 1ce8 n GLN 1071N -3.66 0.10 -3.00 0.00 6.02 -0.49 -4.68 117.38 111.67 1ce8 n GLN 1071Ca -0.01 0.21 -0.41 0.00 -0.01 0.00 0.00 57.00 56.78 1ce8 n GLN 1071Cb 0.58 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 30.29 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 -2.79 4.89 -2.54 5.09 1.01 -0.98 -4.79 121.20 121.09 1ce8 s ILE 1072Ca 0.10 1.28 0.28 0.00 0.00 0.00 0.00 60.65 62.31 1ce8 s ILE 1072Cb 0.09 -4.04 0.52 0.00 0.01 0.00 0.00 42.46 39.04 1ce8 s ILE 1072CO 0.24 -0.07 1.71 0.29 0.00 0.00 0.00 174.94 177.10