#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 1.85 -2.43 0.03 -0.04 -1.26 -3.50 135.00 129.65 1ce8 n PRO 2 Ca 0.00 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.11 1ce8 n PRO 2 Cb 0.00 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.44 1ce8 n PRO 2 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1ce8 s LYS 3 N 0.00 3.76 0.22 0.54 -2.85 -1.26 -3.24 119.74 116.91 1ce8 s LYS 3 Ca 0.00 1.53 -0.30 0.00 -1.00 0.00 0.00 55.97 56.19 1ce8 s LYS 3 Cb 0.00 -2.22 -0.09 0.00 -2.06 0.00 0.00 37.83 33.46 1ce8 s LYS 3 CO 0.00 -0.50 1.35 0.50 0.10 0.00 0.00 175.35 176.80 1ce8 s ARG 4 N -3.00 4.35 0.06 1.78 3.52 0.62 -4.94 118.95 121.34 1ce8 s ARG 4 Ca 0.66 2.14 0.21 0.00 -0.13 0.00 0.00 55.73 58.62 1ce8 s ARG 4 Cb -0.21 -3.16 -0.18 0.00 -1.56 0.00 0.00 34.95 29.84 1ce8 s ARG 4 CO 0.26 -0.30 0.71 -2.37 -0.81 0.00 0.00 175.30 172.79 1ce8 n THR 5 N 2.41 0.45 1.07 4.11 5.66 -1.26 -4.10 114.28 122.61 1ce8 n THR 5 Ca 0.06 -0.56 0.11 0.00 -3.05 0.00 0.00 64.05 60.61 1ce8 n THR 5 Cb 0.42 -0.23 0.57 0.00 -1.55 0.00 0.00 70.33 69.53 1ce8 n THR 5 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1ce8 n ASP 6 N -2.52 0.00 -4.23 1.09 5.75 -1.26 -4.67 116.55 110.71 1ce8 n ASP 6 Ca -0.05 -0.06 -0.30 0.00 -0.01 0.00 0.00 54.79 54.37 1ce8 n ASP 6 Cb 0.62 -0.28 -0.17 0.00 -1.03 0.00 0.00 41.12 40.27 1ce8 n ASP 6 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1ce8 s ILE 7 N -2.55 1.92 0.00 2.12 1.01 -1.26 -4.97 121.20 117.46 1ce8 s ILE 7 Ca 0.22 -0.98 0.00 0.00 0.00 0.00 0.00 60.65 59.89 1ce8 s ILE 7 Cb 0.15 -1.63 0.00 0.00 0.01 0.00 0.00 42.46 40.99 1ce8 s ILE 7 CO 0.34 0.53 0.00 0.29 0.00 0.00 0.00 174.94 176.10 1ce8 n LYS 8 N 3.13 2.85 -4.70 2.79 4.01 -1.26 -4.92 118.16 120.06 1ce8 n LYS 8 Ca -0.18 0.00 -0.25 0.00 -0.51 0.00 0.00 58.31 57.37 1ce8 n LYS 8 Cb 0.52 -0.94 -0.16 0.00 -0.51 0.00 0.00 35.03 33.94 1ce8 n LYS 8 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 1ce8 s SER 9 N -2.97 1.91 -0.01 4.39 1.04 -1.26 0.46 113.70 117.26 1ce8 s SER 9 Ca 0.00 -0.31 0.04 0.00 0.48 0.00 0.00 55.95 56.16 1ce8 s SER 9 Cb 0.00 -0.61 -0.01 0.00 0.10 0.00 0.00 66.02 65.49 1ce8 s SER 9 CO 0.00 0.11 -0.15 -0.63 0.98 0.00 0.00 173.24 173.55 1ce8 s ILE 10 N 0.21 1.16 -0.26 -1.02 1.01 0.10 -1.55 121.20 120.84 1ce8 s ILE 10 Ca -0.06 -0.62 -0.09 0.00 0.00 0.00 0.00 60.65 59.87 1ce8 s ILE 10 Cb -0.12 -0.96 -0.04 0.00 0.01 0.00 0.00 42.46 41.34 1ce8 s ILE 10 CO 0.02 0.33 0.14 -0.22 0.00 0.00 0.00 174.94 175.21 1ce8 s LEU 11 N -0.34 3.80 -0.23 2.97 2.96 0.89 -0.20 118.68 128.53 1ce8 s LEU 11 Ca 0.05 -0.07 -0.07 0.00 -0.22 0.00 0.00 54.13 53.82 1ce8 s LEU 11 Cb -0.06 -2.04 -0.03 0.00 0.50 0.00 0.00 46.19 44.56 1ce8 s LEU 11 CO -0.01 -0.03 0.07 -0.63 -1.32 0.00 0.00 176.35 174.44 1ce8 s ILE 12 N 1.61 4.43 -0.48 6.68 1.01 0.35 -0.19 121.20 134.62 1ce8 s ILE 12 Ca 0.07 -0.14 -0.27 0.00 0.00 0.00 0.00 60.65 60.31 1ce8 s ILE 12 Cb -0.15 -3.05 0.03 0.00 0.01 0.00 0.00 42.46 39.29 1ce8 s ILE 12 CO 0.07 0.36 1.02 -0.76 0.00 0.00 0.00 174.94 175.64 1ce8 s LEU 13 N 1.34 3.85 0.94 2.97 1.43 -0.99 -2.05 118.68 126.17 1ce8 s LEU 13 Ca 0.05 0.21 -0.12 0.00 -1.03 0.00 0.00 54.13 53.24 1ce8 s LEU 13 Cb -0.15 -3.30 0.15 0.00 0.03 0.00 0.00 46.19 42.93 1ce8 s LEU 13 CO 0.04 -1.16 1.11 -0.83 0.23 0.00 0.00 176.35 175.73 1ce8 s GLY 14 N 2.41 1.58 0.28 -3.19 0.00 0.12 -3.02 107.32 105.51 1ce8 s GLY 14 Ca 0.41 -0.37 0.20 0.00 0.00 0.00 0.00 44.72 44.96 1ce8 s GLY 14 CO 0.28 0.19 1.29 0.00 0.00 0.00 0.00 173.10 174.86 1ce8 h ALA 15 N -1.65 0.73 0.00 3.20 0.00 -1.82 -3.38 119.26 116.33 1ce8 h ALA 15 Ca -0.52 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.17 1ce8 h ALA 15 Cb 1.32 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1ce8 h ALA 15 CO 0.59 0.27 0.00 0.41 0.00 0.00 0.00 179.25 180.52 1ce8 n GLY 16 N 1.19 -1.81 3.73 0.00 0.00 -1.26 -4.73 105.19 102.32 1ce8 n GLY 16 Ca 0.00 -1.73 -0.34 0.00 0.00 0.00 0.00 46.02 43.95 1ce8 n GLY 16 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ce8 s PRO 17 N 0.00 2.37 0.08 1.61 0.04 -1.26 -4.45 135.00 133.39 1ce8 s PRO 17 Ca 0.00 1.72 -0.31 0.00 0.04 0.00 0.00 61.00 62.45 1ce8 s PRO 17 Cb 0.00 -1.87 -0.07 0.00 0.04 0.00 0.00 34.50 32.61 1ce8 s PRO 17 CO 0.00 -1.65 1.36 0.42 0.04 0.00 0.00 177.00 177.17 1ce8 s ILE 18 N -1.96 3.53 0.20 0.56 -1.09 -1.26 -4.91 121.20 116.27 1ce8 s ILE 18 Ca 0.74 1.07 0.02 0.00 -2.23 0.00 0.00 60.65 60.24 1ce8 s ILE 18 Cb -0.28 -3.68 -0.05 0.00 -1.58 0.00 0.00 42.46 36.87 1ce8 s ILE 18 CO 0.43 0.06 0.03 0.68 -1.23 0.00 0.00 174.94 174.90 1ce8 s VAL 19 N 1.42 0.68 0.16 2.92 -7.23 -0.61 -2.41 120.40 115.33 1ce8 s VAL 19 Ca 0.63 -1.99 -0.32 0.00 -1.81 0.00 0.00 61.98 58.50 1ce8 s VAL 19 Cb -0.34 -2.28 -0.10 0.00 0.56 0.00 0.00 36.38 34.22 1ce8 s VAL 19 CO 0.29 -0.34 1.64 -0.63 -0.31 0.00 0.00 175.10 175.76 1ce8 s ILE 20 N -3.66 2.50 0.00 -0.62 1.01 -1.26 -1.24 121.20 117.92 1ce8 s ILE 20 Ca 0.28 0.30 0.00 0.00 0.00 0.00 0.00 60.65 61.23 1ce8 s ILE 20 Cb 0.06 -3.19 0.00 0.00 0.01 0.00 0.00 42.46 39.34 1ce8 s ILE 20 CO 0.07 0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.64 1ce8 n GLY 21 N 3.88 2.65 2.47 6.18 0.00 -1.26 -4.91 105.19 114.19 1ce8 n GLY 21 Ca 0.15 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 1ce8 n GLY 21 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ce8 s GLN 22 N -0.61 0.85 0.00 1.61 0.74 -0.37 -4.66 119.66 117.21 1ce8 s GLN 22 Ca 0.00 -1.79 0.00 0.00 0.05 0.00 0.00 55.36 53.62 1ce8 s GLN 22 Cb 0.00 -1.20 0.00 0.00 1.10 0.00 0.00 33.01 32.91 1ce8 s GLN 22 CO 0.00 -1.34 0.00 0.00 -0.55 0.00 0.00 175.29 173.40 1ce8 n ALA 23 N 3.14 0.00 -0.38 1.58 0.00 -1.24 -1.57 120.51 122.03 1ce8 n ALA 23 Ca 0.25 0.00 0.36 0.00 0.00 0.00 0.00 53.44 54.05 1ce8 n ALA 23 Cb 0.47 0.00 0.72 0.00 0.00 0.00 0.00 19.45 20.64 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 0.06 0.00 0.00 0.00 9.09 -1.90 0.27 114.58 122.10 1ce8 h GLU 25 Ca 0.63 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.04 1ce8 h GLU 25 Cb 2.38 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 29.48 1ce8 h GLU 25 CO -0.08 0.00 -0.19 0.74 0.05 0.00 0.00 179.01 179.53 1ce8 h PHE 26 N 0.00 0.00 0.09 2.06 0.04 -1.64 -1.64 116.94 115.85 1ce8 h PHE 26 Ca 0.40 0.00 -0.27 0.00 2.80 0.00 0.00 57.97 60.90 1ce8 h PHE 26 Cb 2.04 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 40.19 1ce8 h PHE 26 CO 0.00 0.00 -1.30 0.22 -0.60 0.00 0.00 178.31 176.63 1ce8 h ASP 27 N 0.00 0.31 -0.07 2.17 3.58 -0.69 -1.23 116.42 120.48 1ce8 h ASP 27 Ca 0.00 -0.36 -0.01 0.00 0.42 0.00 0.00 57.03 57.07 1ce8 h ASP 27 Cb 0.98 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 41.93 1ce8 h ASP 27 CO 0.00 1.29 -0.01 0.22 -2.88 0.00 0.00 179.24 177.86 1ce8 h TYR 28 N 0.05 0.15 -0.41 0.28 3.20 -1.39 -0.16 116.97 118.69 1ce8 h TYR 28 Ca -0.15 -0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.60 1ce8 h TYR 28 Cb 1.95 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 40.17 1ce8 h TYR 28 CO 0.05 0.44 -0.12 0.66 -1.64 0.00 0.00 178.16 177.54 1ce8 h SER 29 N -0.18 0.82 -0.47 -2.11 4.64 -1.39 -1.55 113.55 113.31 1ce8 h SER 29 Ca 0.02 -0.37 -0.14 0.00 -0.47 0.00 0.00 61.79 60.83 1ce8 h SER 29 Cb 0.38 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 1ce8 h SER 29 CO 0.01 1.00 -0.25 1.23 -0.87 0.00 0.00 176.83 177.95 1ce8 h GLY 30 N 0.62 1.08 1.03 -0.77 0.00 -1.22 0.47 103.07 104.28 1ce8 h GLY 30 Ca 0.10 -0.98 -0.04 0.00 0.00 0.00 0.00 47.33 46.41 1ce8 h GLY 30 CO 0.04 0.89 0.29 0.00 0.00 0.00 0.00 176.54 177.77 1ce8 h ALA 31 N 0.85 0.94 0.19 3.60 0.00 -1.00 -0.44 119.26 123.40 1ce8 h ALA 31 Ca 0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1ce8 h ALA 31 Cb 0.83 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1ce8 h ALA 31 CO 0.07 0.56 -0.09 1.96 0.00 0.00 0.00 179.25 181.75 1ce8 h GLN 32 N 1.03 -0.25 -0.78 0.00 4.20 -0.73 -1.58 115.11 117.00 1ce8 h GLN 32 Ca 0.24 0.02 0.12 0.00 0.06 0.00 0.00 58.65 59.08 1ce8 h GLN 32 Cb 0.21 0.06 -0.08 0.00 0.30 0.00 0.00 27.48 27.96 1ce8 h GLN 32 CO -0.02 -0.11 0.40 0.00 -0.67 0.00 0.00 178.83 178.42 1ce8 h ALA 33 N 0.47 1.12 0.06 3.87 0.00 -0.72 0.41 119.26 124.47 1ce8 h ALA 33 Ca -0.03 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1ce8 h ALA 33 Cb 0.25 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1ce8 h ALA 33 CO 0.04 -0.05 -0.03 0.00 0.00 0.00 0.00 179.25 179.21 1ce8 h LYS 35 N -0.24 0.35 0.00 0.00 3.64 -0.87 0.70 116.57 120.15 1ce8 h LYS 35 Ca -0.01 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.28 1ce8 h LYS 35 Cb 0.21 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1ce8 h LYS 35 CO 0.01 0.23 -0.35 0.00 -2.27 0.00 0.00 179.45 177.08 1ce8 h ALA 36 N 1.38 1.14 0.03 5.00 0.00 -0.78 -0.50 119.26 125.52 1ce8 h ALA 36 Ca 0.27 -0.32 -0.28 0.00 0.00 0.00 0.00 54.91 54.59 1ce8 h ALA 36 Cb 0.32 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1ce8 h ALA 36 CO -0.29 0.43 -1.50 -0.07 0.00 0.00 0.00 179.25 177.83 1ce8 h LEU 37 N 0.00 0.09 -0.11 0.00 3.38 -0.63 -3.08 115.31 114.96 1ce8 h LEU 37 Ca -0.00 -0.14 -0.14 0.00 0.09 0.00 0.00 57.88 57.68 1ce8 h LEU 37 Cb 0.76 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.48 1ce8 h LEU 37 CO 0.05 1.12 -0.49 -0.09 0.09 0.00 0.00 178.44 179.12 1ce8 h ARG 38 N 0.02 0.54 -0.52 1.13 2.43 -0.85 0.10 114.38 117.23 1ce8 h ARG 38 Ca -0.21 -0.42 0.08 0.00 -0.81 0.00 0.00 59.98 58.62 1ce8 h ARG 38 Cb 1.95 0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 31.52 1ce8 h ARG 38 CO 0.11 1.05 0.15 1.49 -1.51 0.00 0.00 179.97 181.25 1ce8 h GLU 39 N 0.14 0.29 -0.23 0.20 4.81 -1.20 -0.93 114.58 117.66 1ce8 h GLU 39 Ca -0.03 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1ce8 h GLU 39 Cb 1.13 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.44 1ce8 h GLU 39 CO 0.10 0.19 0.00 0.39 -0.73 0.00 0.00 179.01 178.97 1ce8 n GLU 40 N -5.06 0.91 -1.75 1.92 -0.58 -1.16 -4.89 120.64 110.02 1ce8 n GLU 40 Ca 0.06 0.00 -0.10 0.00 -0.42 0.00 0.00 57.16 56.70 1ce8 n GLU 40 Cb 0.24 -1.12 -0.02 0.00 -0.57 0.00 0.00 31.44 29.97 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 0.31 0.52 3.95 0.62 0.00 -0.35 -5.04 105.19 105.20 1ce8 n GLY 41 Ca 0.00 -0.53 -0.24 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.42 3.48 -0.32 1.61 1.51 0.02 -5.01 117.35 116.21 1ce8 s TYR 42 Ca 0.00 0.24 -0.23 0.00 -1.01 0.00 0.00 57.07 56.06 1ce8 s TYR 42 Cb 0.00 -1.79 0.00 0.00 -0.11 0.00 0.00 41.96 40.06 1ce8 s TYR 42 CO 0.00 0.27 0.79 0.50 -1.11 0.00 0.00 175.55 176.00 1ce8 s ARG 43 N -4.02 3.90 -0.29 -0.62 3.52 0.17 -4.41 118.95 117.20 1ce8 s ARG 43 Ca 0.38 0.51 -0.12 0.00 -0.13 0.00 0.00 55.73 56.37 1ce8 s ARG 43 Cb -0.10 -3.75 -0.04 0.00 -1.56 0.00 0.00 34.95 29.50 1ce8 s ARG 43 CO 0.32 -0.73 0.24 0.08 -0.81 0.00 0.00 175.30 174.40 1ce8 s VAL 44 N 3.01 5.27 -0.08 7.11 1.01 -1.26 0.00 120.40 135.47 1ce8 s VAL 44 Ca 0.32 0.17 0.05 0.00 0.00 0.00 0.00 61.98 62.52 1ce8 s VAL 44 Cb -0.14 -3.61 -0.00 0.00 0.00 0.00 0.00 36.38 32.63 1ce8 s VAL 44 CO 0.14 0.17 -0.24 -0.63 0.00 0.00 0.00 175.10 174.54 1ce8 s ILE 45 N 1.83 2.00 0.01 2.22 1.01 0.72 -0.43 121.20 128.55 1ce8 s ILE 45 Ca 0.09 -1.01 -0.08 0.00 0.00 0.00 0.00 60.65 59.65 1ce8 s ILE 45 Cb -0.16 -1.71 0.00 0.00 0.01 0.00 0.00 42.46 40.60 1ce8 s ILE 45 CO 0.11 0.55 0.15 0.54 0.00 0.00 0.00 174.94 176.29 1ce8 s ASN 46 N 0.13 0.02 -0.05 3.58 4.22 -0.75 0.13 114.94 122.22 1ce8 s ASN 46 Ca -0.12 -0.22 0.05 0.00 -2.14 0.00 0.00 52.86 50.43 1ce8 s ASN 46 Cb -0.16 0.22 -0.02 0.00 1.28 0.00 0.00 41.25 42.57 1ce8 s ASN 46 CO 0.06 -0.40 -0.21 0.54 -2.04 0.00 0.00 177.10 175.06 1ce8 s VAL 47 N -1.53 2.48 -0.30 3.54 0.11 -0.87 -0.87 120.40 122.95 1ce8 s VAL 47 Ca -0.14 -0.93 -0.07 0.00 -2.93 0.00 0.00 61.98 57.92 1ce8 s VAL 47 Cb -0.07 -1.93 0.18 0.00 -1.53 0.00 0.00 36.38 33.03 1ce8 s VAL 47 CO 0.01 0.57 0.79 0.21 -3.33 0.00 0.00 175.10 173.35 1ce8 s ASN 48 N -0.38 -0.98 0.58 3.54 3.84 -0.17 -0.70 114.94 120.66 1ce8 s ASN 48 Ca 0.03 0.76 0.36 0.00 0.21 0.00 0.00 52.86 54.23 1ce8 s ASN 48 Cb -0.12 1.89 1.68 0.00 -0.55 0.00 0.00 41.25 44.14 1ce8 s ASN 48 CO 0.02 -0.18 2.10 0.77 -2.79 0.00 0.00 177.10 177.01 1ce8 h SER 49 N 7.94 0.00 -3.47 -4.21 4.64 -1.78 -3.37 113.55 113.29 1ce8 h SER 49 Ca -0.19 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.57 1ce8 h SER 49 Cb 1.15 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.18 1ce8 h SER 49 CO 0.11 0.01 0.91 0.21 -0.87 0.00 0.00 176.83 177.20 1ce8 s ASN 50 N -5.57 6.75 0.44 4.97 2.47 -1.26 -1.04 114.94 121.69 1ce8 s ASN 50 Ca -0.01 0.80 0.24 0.00 0.42 0.00 0.00 52.86 54.31 1ce8 s ASN 50 Cb 0.10 -2.55 0.44 0.00 -1.45 0.00 0.00 41.25 37.80 1ce8 s ASN 50 CO 0.51 -1.09 1.65 1.55 -3.72 0.00 0.00 177.10 175.99 1ce8 h PRO 51 N 8.84 0.00 -1.38 0.43 0.13 -1.82 -3.30 132.00 134.89 1ce8 h PRO 51 Ca -0.22 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.82 1ce8 h PRO 51 Cb 1.07 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.15 1ce8 h PRO 51 CO 1.08 0.00 0.11 0.00 -0.23 0.00 0.00 178.00 178.96 1ce8 n ALA 52 N -2.08 3.59 -2.44 -0.56 0.00 -1.26 -4.71 120.51 113.04 1ce8 n ALA 52 Ca 0.04 -0.47 -0.32 0.00 0.00 0.00 0.00 53.44 52.69 1ce8 n ALA 52 Cb 0.51 -1.09 -0.13 0.00 0.00 0.00 0.00 19.45 18.73 1ce8 n ALA 52 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1ce8 s THR 53 N -0.60 2.81 0.25 0.00 -4.23 -1.24 -4.67 115.64 107.96 1ce8 s THR 53 Ca 0.09 -0.94 0.04 0.00 -1.18 0.00 0.00 61.69 59.71 1ce8 s THR 53 Cb 0.07 -2.11 -0.01 0.00 1.34 0.00 0.00 72.50 71.79 1ce8 s THR 53 CO 0.01 0.51 1.60 0.40 -0.54 0.00 0.00 174.62 176.60 1ce8 h ILE 54 N 4.23 1.35 0.00 2.99 1.08 -1.88 -2.72 117.51 122.57 1ce8 h ILE 54 Ca -0.46 -1.79 -0.01 0.00 -0.39 0.00 0.00 64.86 62.21 1ce8 h ILE 54 Cb 1.15 1.85 -0.00 0.00 -3.07 0.00 0.00 36.82 36.75 1ce8 h ILE 54 CO 0.49 0.54 -0.02 0.00 -0.69 0.00 0.00 178.15 178.46 1ce8 h MET 55 N 0.22 0.00 -0.30 2.37 -0.00 -1.92 0.40 114.93 115.70 1ce8 h MET 55 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.71 1ce8 h MET 55 Cb 1.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.60 1ce8 h MET 55 CO 0.08 0.02 0.00 0.25 -0.00 0.00 0.00 176.91 177.27 1ce8 n THR 56 N -3.51 0.39 -2.17 -0.10 -2.24 -1.02 -4.77 114.28 100.85 1ce8 n THR 56 Ca -0.03 -0.47 -0.41 0.00 -2.27 0.00 0.00 64.05 60.88 1ce8 n THR 56 Cb 0.12 0.37 -0.02 0.00 -2.10 0.00 0.00 70.33 68.70 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 -1.29 6.85 0.17 3.42 1.11 0.14 -4.90 116.67 122.17 1ce8 s ASP 57 Ca 0.30 2.61 -0.15 0.00 0.18 0.00 0.00 52.55 55.49 1ce8 s ASP 57 Cb 0.16 -2.64 0.11 0.00 1.07 0.00 0.00 42.92 41.62 1ce8 s ASP 57 CO 0.23 -0.48 1.73 1.55 1.18 0.00 0.00 175.17 179.38 1ce8 h PRO 58 N 3.64 0.24 0.00 8.23 0.13 -1.89 -2.11 132.00 140.23 1ce8 h PRO 58 Ca -0.48 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1ce8 h PRO 58 Cb 1.22 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1ce8 h PRO 58 CO 0.67 0.16 0.00 1.05 -0.23 0.00 0.00 178.00 179.65 1ce8 h GLU 59 N 0.25 0.00 0.00 0.86 4.11 -1.96 -3.03 114.58 114.81 1ce8 h GLU 59 Ca 0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.63 1ce8 h GLU 59 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1ce8 h GLU 59 CO -0.24 0.00 -0.00 0.52 0.07 0.00 0.00 179.01 179.36 1ce8 h MET 60 N 0.00 0.00 -3.57 1.06 2.86 -1.70 -3.47 114.93 110.12 1ce8 h MET 60 Ca 0.00 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 1ce8 h MET 60 Cb 0.27 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 31.84 1ce8 h MET 60 CO 0.00 0.00 -0.08 0.00 1.06 0.00 0.00 176.91 177.89 1ce8 s ALA 61 N -3.11 -0.40 -0.09 6.32 0.00 -1.14 -4.59 121.76 118.75 1ce8 s ALA 61 Ca 0.10 -0.75 -0.26 0.00 0.00 0.00 0.00 51.96 51.06 1ce8 s ALA 61 Cb 0.12 1.01 -0.28 0.00 0.00 0.00 0.00 23.12 23.97 1ce8 s ALA 61 CO 0.60 -0.85 0.85 -0.44 0.00 0.00 0.00 175.76 175.92 1ce8 h ASP 62 N 2.24 0.21 -3.44 0.00 3.32 -0.99 -3.44 116.42 114.33 1ce8 h ASP 62 Ca -0.26 -0.95 -0.60 0.00 0.02 0.00 0.00 57.03 55.23 1ce8 h ASP 62 Cb 1.25 -0.07 -0.39 0.00 0.22 0.00 0.00 39.33 40.34 1ce8 h ASP 62 CO 0.35 1.15 -0.76 0.00 -1.72 0.00 0.00 179.24 178.26 1ce8 s ALA 63 N -2.42 1.90 -0.29 3.45 0.00 -0.15 -4.86 121.76 119.40 1ce8 s ALA 63 Ca -0.17 -1.64 -0.08 0.00 0.00 0.00 0.00 51.96 50.08 1ce8 s ALA 63 Cb -0.01 -1.58 -0.00 0.00 0.00 0.00 0.00 23.12 21.52 1ce8 s ALA 63 CO 0.75 -1.46 0.10 0.99 0.00 0.00 0.00 175.76 176.14 1ce8 s THR 64 N 1.42 4.22 -0.37 0.00 2.01 -1.26 -1.81 115.64 119.85 1ce8 s THR 64 Ca 0.03 -0.49 -0.09 0.00 0.31 0.00 0.00 61.69 61.46 1ce8 s THR 64 Cb -0.18 -3.12 0.05 0.00 0.01 0.00 0.00 72.50 69.25 1ce8 s THR 64 CO -0.13 0.14 0.18 -0.31 -0.69 0.00 0.00 174.62 173.80 1ce8 s TYR 65 N 1.56 3.28 -1.15 4.92 2.02 -0.05 0.67 117.35 128.59 1ce8 s TYR 65 Ca 0.04 -1.30 -0.11 0.00 -0.37 0.00 0.00 57.07 55.33 1ce8 s TYR 65 Cb -0.17 -2.51 0.23 0.00 -0.40 0.00 0.00 41.96 39.11 1ce8 s TYR 65 CO 0.04 -0.73 1.25 0.42 -1.57 0.00 0.00 175.55 174.95 1ce8 s ILE 66 N 1.46 5.55 0.12 2.71 1.01 -1.26 -1.00 121.20 129.79 1ce8 s ILE 66 Ca 0.01 -3.04 0.02 0.00 0.00 0.00 0.00 60.65 57.64 1ce8 s ILE 66 Cb -0.20 -4.74 -0.04 0.00 0.01 0.00 0.00 42.46 37.48 1ce8 s ILE 66 CO 0.04 -1.38 -0.04 -1.61 0.00 0.00 0.00 174.94 171.94 1ce8 s GLU 67 N 0.07 0.91 0.13 2.79 0.41 -1.26 -4.55 118.70 117.21 1ce8 s GLU 67 Ca 0.36 -1.39 -0.33 0.00 -0.41 0.00 0.00 54.97 53.19 1ce8 s GLU 67 Cb -0.07 -0.20 -0.13 0.00 -1.78 0.00 0.00 34.13 31.95 1ce8 s GLU 67 CO -0.04 -0.06 1.68 -2.30 -0.49 0.00 0.00 175.26 174.05 1ce8 n PRO 68 N -0.10 2.35 -1.23 0.39 -0.01 -1.26 -3.19 135.00 131.95 1ce8 n PRO 68 Ca -0.10 0.85 -0.36 0.00 -0.01 0.00 0.00 63.50 63.87 1ce8 n PRO 68 Cb 0.62 -2.66 -0.03 0.00 -0.01 0.00 0.00 33.50 31.42 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 3.91 3.03 -4.43 4.25 5.41 -1.26 -4.65 119.36 125.62 1ce8 n ILE 69 Ca 0.18 -2.16 -0.34 0.00 1.00 0.00 0.00 62.75 61.42 1ce8 n ILE 69 Cb 0.31 -2.42 -0.12 0.00 -0.71 0.00 0.00 39.64 36.71 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 3.41 3.03 0.51 1.39 2.46 -1.26 -5.01 115.29 119.83 1ce8 s HIS 70 Ca 0.53 -0.17 0.28 0.00 0.47 0.00 0.00 55.06 56.18 1ce8 s HIS 70 Cb 0.14 -1.89 1.40 0.00 -0.13 0.00 0.00 32.58 32.10 1ce8 s HIS 70 CO -0.02 0.10 1.89 0.11 -2.47 0.00 0.00 174.74 174.36 1ce8 h TRP 71 N 6.24 0.10 -0.23 3.88 5.08 -1.93 0.45 115.95 129.54 1ce8 h TRP 71 Ca -0.37 0.00 -0.20 0.00 1.08 0.00 0.00 58.89 59.41 1ce8 h TRP 71 Cb 1.19 -0.03 0.00 0.00 -3.00 0.00 0.00 29.16 27.32 1ce8 h TRP 71 CO 0.55 0.02 -0.63 0.93 -1.28 0.00 0.00 178.44 178.03 1ce8 h GLU 72 N 0.07 0.80 -0.12 0.12 5.08 -1.95 -1.47 114.58 117.12 1ce8 h GLU 72 Ca 0.42 -0.56 -0.15 0.00 -1.00 0.00 0.00 59.36 58.07 1ce8 h GLU 72 Cb 1.54 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.87 1ce8 h GLU 72 CO -0.04 1.19 -0.57 0.28 -1.00 0.00 0.00 179.01 178.87 1ce8 h VAL 73 N 0.59 1.35 -0.08 3.13 2.07 -1.07 -2.76 116.25 119.48 1ce8 h VAL 73 Ca -0.01 -1.87 -0.10 0.00 0.82 0.00 0.00 66.70 65.54 1ce8 h VAL 73 Cb 1.24 1.88 -0.01 0.00 -1.52 0.00 0.00 31.29 32.88 1ce8 h VAL 73 CO 0.13 0.56 -0.42 0.58 0.02 0.00 0.00 177.57 178.45 1ce8 h VAL 74 N 0.29 1.31 -0.56 2.57 2.07 -0.11 -2.34 116.25 119.49 1ce8 h VAL 74 Ca 0.00 -1.53 -0.08 0.00 0.82 0.00 0.00 66.70 65.92 1ce8 h VAL 74 Cb 1.08 1.72 -0.02 0.00 -1.52 0.00 0.00 31.29 32.55 1ce8 h VAL 74 CO 0.10 0.45 0.03 -0.09 0.02 0.00 0.00 177.57 178.08 1ce8 h ARG 75 N 0.15 0.94 -0.33 1.57 2.43 -0.99 -0.82 114.38 117.33 1ce8 h ARG 75 Ca 0.01 -0.26 -0.03 0.00 -0.81 0.00 0.00 59.98 58.90 1ce8 h ARG 75 Cb 0.81 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.24 1ce8 h ARG 75 CO 0.06 0.91 0.10 0.87 -1.51 0.00 0.00 179.97 180.40 1ce8 h LYS 76 N 0.87 0.52 -0.89 0.20 1.79 -1.23 0.16 116.57 117.99 1ce8 h LYS 76 Ca 0.17 -0.11 0.11 0.00 -2.18 0.00 0.00 60.65 58.63 1ce8 h LYS 76 Cb 0.47 -0.07 -0.08 0.00 -1.58 0.00 0.00 32.23 30.96 1ce8 h LYS 76 CO 0.02 0.55 0.53 0.82 -1.08 0.00 0.00 179.45 180.29 1ce8 h ILE 77 N 0.38 0.90 -0.12 1.86 2.04 -1.03 0.50 117.51 122.04 1ce8 h ILE 77 Ca 0.11 -0.29 -0.05 0.00 1.00 0.00 0.00 64.86 65.62 1ce8 h ILE 77 Cb 0.25 -0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 36.30 1ce8 h ILE 77 CO -0.00 0.16 -0.13 0.40 0.00 0.00 0.00 178.15 178.58 1ce8 h ILE 78 N 0.85 1.36 -0.89 -0.67 2.04 -0.66 0.21 117.51 119.75 1ce8 h ILE 78 Ca 0.44 -1.30 0.04 0.00 1.00 0.00 0.00 64.86 65.04 1ce8 h ILE 78 Cb 0.44 1.96 -0.05 0.00 -0.74 0.00 0.00 36.82 38.42 1ce8 h ILE 78 CO -0.27 0.37 0.57 -0.08 0.00 0.00 0.00 178.15 178.75 1ce8 h GLU 79 N -0.11 1.07 0.00 2.37 4.81 -0.00 0.69 114.58 123.41 1ce8 h GLU 79 Ca 0.02 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.08 1ce8 h GLU 79 Cb 0.66 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 1ce8 h GLU 79 CO 0.03 0.71 -0.47 -0.22 -0.73 0.00 0.00 179.01 178.33 1ce8 h LYS 80 N 1.11 0.00 0.00 1.92 3.64 0.16 -3.35 116.57 120.05 1ce8 h LYS 80 Ca 0.36 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.69 1ce8 h LYS 80 Cb 0.02 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1ce8 h LYS 80 CO -0.12 0.47 -1.73 0.39 -2.27 0.00 0.00 179.45 176.19 1ce8 n GLU 81 N -3.33 0.68 -3.75 1.90 -0.58 0.71 -5.01 120.64 111.27 1ce8 n GLU 81 Ca 0.01 -0.11 -0.26 0.00 -0.42 0.00 0.00 57.16 56.38 1ce8 n GLU 81 Cb 0.66 -1.36 0.02 0.00 -0.57 0.00 0.00 31.44 30.20 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 -2.11 -2.89 -2.17 3.49 5.12 0.24 -4.89 116.66 113.44 1ce8 n ARG 82 Ca -0.06 0.50 -0.39 0.00 -1.93 0.00 0.00 57.85 55.97 1ce8 n ARG 82 Cb 0.49 -4.61 -0.01 0.00 -1.16 0.00 0.00 32.46 27.17 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 -6.08 3.98 0.21 5.56 0.04 -1.26 -4.91 135.00 132.55 1ce8 s PRO 83 Ca 0.20 1.98 -0.03 0.00 0.04 0.00 0.00 61.00 63.20 1ce8 s PRO 83 Cb -0.07 -2.69 0.19 0.00 0.04 0.00 0.00 34.50 31.97 1ce8 s PRO 83 CO 0.85 -0.43 1.59 -0.44 0.04 0.00 0.00 177.00 178.61 1ce8 h ASP 84 N 2.60 0.66 -5.38 6.66 3.32 -1.57 -3.42 116.42 119.30 1ce8 h ASP 84 Ca -0.49 -0.29 -0.16 0.00 0.02 0.00 0.00 57.03 56.11 1ce8 h ASP 84 Cb 1.24 -0.19 -0.14 0.00 0.22 0.00 0.00 39.33 40.47 1ce8 h ASP 84 CO 0.62 0.97 -0.54 0.00 -1.72 0.00 0.00 179.24 178.57 1ce8 s ALA 85 N -4.31 0.59 -0.09 3.45 0.00 -0.96 -0.37 121.76 120.08 1ce8 s ALA 85 Ca -0.08 -1.28 0.02 0.00 0.00 0.00 0.00 51.96 50.62 1ce8 s ALA 85 Cb 0.12 0.87 0.01 0.00 0.00 0.00 0.00 23.12 24.13 1ce8 s ALA 85 CO 0.83 -0.54 -0.14 0.54 0.00 0.00 0.00 175.76 176.45 1ce8 s VAL 86 N -4.02 1.35 -0.48 0.00 0.11 0.18 -0.08 120.40 117.46 1ce8 s VAL 86 Ca 0.22 -0.58 -0.14 0.00 -2.93 0.00 0.00 61.98 58.56 1ce8 s VAL 86 Cb 0.06 -1.23 0.09 0.00 -1.53 0.00 0.00 36.38 33.77 1ce8 s VAL 86 CO 0.01 0.41 0.39 -0.22 -3.33 0.00 0.00 175.10 172.36 1ce8 s LEU 87 N 0.82 5.69 -0.04 2.54 2.96 0.74 -1.58 118.68 129.81 1ce8 s LEU 87 Ca -0.11 -1.55 0.19 0.00 -0.22 0.00 0.00 54.13 52.45 1ce8 s LEU 87 Cb -0.15 -2.13 0.60 0.00 0.50 0.00 0.00 46.19 45.00 1ce8 s LEU 87 CO 0.02 -0.69 1.51 -0.81 -1.32 0.00 0.00 176.35 175.06 1ce8 n PRO 88 N 5.13 3.04 -0.25 0.98 -0.04 -1.26 -2.35 135.00 140.26 1ce8 n PRO 88 Ca -0.12 -2.62 0.11 0.00 -0.04 0.00 0.00 63.50 60.83 1ce8 n PRO 88 Cb 0.42 -1.61 0.27 0.00 -0.04 0.00 0.00 33.50 32.54 1ce8 n PRO 88 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1ce8 n THR 89 N 1.22 0.66 -0.29 0.52 -2.24 -1.26 -3.86 114.28 109.03 1ce8 n THR 89 Ca 0.22 -0.76 0.04 0.00 -2.27 0.00 0.00 64.05 61.28 1ce8 n THR 89 Cb 0.67 0.61 0.09 0.00 -2.10 0.00 0.00 70.33 69.59 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 1.29 2.71 -2.31 -0.78 2.81 -1.26 -2.38 117.12 117.20 1ce8 n MET 90 Ca 0.20 -1.94 -0.19 0.00 -1.81 0.00 0.00 57.70 53.96 1ce8 n MET 90 Cb 0.54 -1.23 0.02 0.00 -0.71 0.00 0.00 33.22 31.84 1ce8 n MET 90 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ce8 n GLY 91 N -0.34 5.12 7.00 3.03 0.00 -1.17 -4.25 105.19 114.58 1ce8 n GLY 91 Ca 0.08 -2.29 0.00 0.00 0.00 0.00 0.00 46.02 43.80 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 -0.60 1.51 0.09 -0.02 0.00 -1.26 -1.69 105.19 103.22 1ce8 n GLY 92 Ca 0.34 -0.56 -0.04 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.38 1.61 5.75 -1.95 -3.11 115.11 117.03 1ce8 h GLN 93 Ca 0.00 0.00 0.05 0.00 -0.15 0.00 0.00 58.65 58.55 1ce8 h GLN 93 Cb 0.00 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 28.50 1ce8 h GLN 93 CO 0.00 0.68 0.10 1.15 -2.65 0.00 0.00 178.83 178.10 1ce8 h THR 94 N 0.00 0.84 -0.38 2.39 2.02 -1.84 0.26 112.91 116.20 1ce8 h THR 94 Ca -0.08 -0.08 -0.06 0.00 0.77 0.00 0.00 66.41 66.96 1ce8 h THR 94 Cb 1.69 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 68.66 1ce8 h THR 94 CO 0.09 0.04 -0.02 0.00 0.37 0.00 0.00 175.52 176.00 1ce8 h ALA 95 N 1.27 1.25 -0.08 6.16 0.00 -1.38 0.11 119.26 126.59 1ce8 h ALA 95 Ca 0.18 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1ce8 h ALA 95 Cb 0.19 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ce8 h ALA 95 CO -0.22 0.50 -0.11 -0.07 0.00 0.00 0.00 179.25 179.35 1ce8 h LEU 96 N 0.58 0.24 -0.13 0.00 3.38 -1.32 -2.28 115.31 115.78 1ce8 h LEU 96 Ca 0.12 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1ce8 h LEU 96 Cb 0.40 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1ce8 h LEU 96 CO 0.02 0.71 0.09 0.78 0.09 0.00 0.00 178.44 180.12 1ce8 h ASN 97 N -0.22 0.15 -0.17 -0.43 2.35 -0.22 -2.34 115.58 114.70 1ce8 h ASN 97 Ca 0.01 -0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 1ce8 h ASN 97 Cb 0.65 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.97 1ce8 h ASN 97 CO 0.03 0.11 0.04 0.00 -1.65 0.00 0.00 177.43 175.96 1ce8 h ALA 99 N 1.11 0.67 0.00 0.00 0.00 -1.29 -0.31 119.26 119.44 1ce8 h ALA 99 Ca 0.07 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1ce8 h ALA 99 Cb 0.06 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1ce8 h ALA 99 CO -0.09 -0.17 -0.12 -0.07 0.00 0.00 0.00 179.25 178.80 1ce8 h LEU 100 N 0.41 0.00 -0.01 0.00 4.07 -1.06 -2.11 115.31 116.61 1ce8 h LEU 100 Ca 0.25 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 58.18 1ce8 h LEU 100 Cb 0.25 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.99 1ce8 h LEU 100 CO -0.23 0.12 -0.13 -0.08 -1.08 0.00 0.00 178.44 177.03 1ce8 h GLU 101 N 0.00 0.11 -0.87 1.13 4.57 0.02 -1.86 114.58 117.68 1ce8 h GLU 101 Ca -0.00 -0.10 0.08 0.00 -1.18 0.00 0.00 59.36 58.15 1ce8 h GLU 101 Cb 0.75 0.03 -0.07 0.00 -0.16 0.00 0.00 28.75 29.30 1ce8 h GLU 101 CO 0.02 0.82 0.53 -0.07 -1.18 0.00 0.00 179.01 179.12 1ce8 h LEU 102 N -0.56 0.81 -0.51 1.64 3.38 -1.07 0.52 115.31 119.52 1ce8 h LEU 102 Ca -0.01 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1ce8 h LEU 102 Cb 0.85 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 1ce8 h LEU 102 CO 0.03 0.50 0.27 -0.08 0.09 0.00 0.00 178.44 179.24 1ce8 h GLU 103 N 0.93 0.72 -0.35 1.13 4.57 -1.39 0.16 114.58 120.35 1ce8 h GLU 103 Ca 0.39 -0.09 -0.11 0.00 -1.18 0.00 0.00 59.36 58.37 1ce8 h GLU 103 Cb 0.25 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.69 1ce8 h GLU 103 CO -0.20 0.57 -0.23 -0.09 -1.18 0.00 0.00 179.01 177.88 1ce8 h ARG 104 N 0.68 0.69 0.00 1.92 2.43 -0.38 -1.81 114.38 117.91 1ce8 h ARG 104 Ca 0.18 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1ce8 h ARG 104 Cb 0.07 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1ce8 h ARG 104 CO -0.03 0.86 0.00 1.04 -1.51 0.00 0.00 179.97 180.34 1ce8 n GLN 105 N -4.11 0.25 -1.15 0.20 1.13 0.17 -4.89 117.38 108.98 1ce8 n GLN 105 Ca -0.00 0.07 -0.05 0.00 -1.94 0.00 0.00 57.00 55.08 1ce8 n GLN 105 Cb 0.43 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 29.26 1ce8 n GLN 105 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ce8 n GLY 106 N 0.81 0.76 0.21 1.08 0.00 -0.46 -4.93 105.19 102.66 1ce8 n GLY 106 Ca 0.10 -0.67 -0.04 0.00 0.00 0.00 0.00 46.02 45.41 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 1.31 -0.53 1.61 2.07 -1.24 -2.22 116.25 117.25 1ce8 h VAL 107 Ca -0.10 -1.54 -0.06 0.00 0.82 0.00 0.00 66.70 65.82 1ce8 h VAL 107 Cb 0.37 1.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.75 1ce8 h VAL 107 CO 0.15 0.47 0.08 -0.07 0.02 0.00 0.00 177.57 178.22 1ce8 h LEU 108 N 0.29 0.84 0.18 2.57 3.38 -1.86 -1.94 115.31 118.78 1ce8 h LEU 108 Ca 0.03 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 1ce8 h LEU 108 Cb 0.84 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1ce8 h LEU 108 CO 0.07 0.90 -0.09 -0.33 0.09 0.00 0.00 178.44 179.08 1ce8 h GLU 109 N 0.76 -0.24 -1.12 1.13 4.39 -1.82 0.27 114.58 117.95 1ce8 h GLU 109 Ca 0.16 0.02 0.32 0.00 0.34 0.00 0.00 59.36 60.19 1ce8 h GLU 109 Cb 0.42 0.05 -0.10 0.00 -0.10 0.00 0.00 28.75 29.02 1ce8 h GLU 109 CO 0.01 0.05 0.72 1.49 -1.16 0.00 0.00 179.01 180.13 1ce8 h GLU 110 N -0.53 0.28 0.00 2.33 4.81 -1.26 -1.63 114.58 118.58 1ce8 h GLU 110 Ca -0.03 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1ce8 h GLU 110 Cb 0.40 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.72 1ce8 h GLU 110 CO 0.04 0.18 -0.01 1.19 -0.73 0.00 0.00 179.01 179.69 1ce8 n PHE 111 N -4.64 0.00 -3.65 0.92 3.01 -0.74 -5.01 117.46 107.35 1ce8 n PHE 111 Ca 0.29 -0.78 -0.30 0.00 1.01 0.00 0.00 57.45 57.66 1ce8 n PHE 111 Cb 1.05 -0.11 0.05 0.00 -0.01 0.00 0.00 39.48 40.46 1ce8 n PHE 111 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ce8 n GLY 112 N -1.05 -1.00 3.47 1.37 0.00 -0.57 -4.87 105.19 102.54 1ce8 n GLY 112 Ca 0.10 0.46 -0.36 0.00 0.00 0.00 0.00 46.02 46.21 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 -3.46 4.44 -0.15 1.61 1.01 0.84 -4.74 120.40 119.95 1ce8 s VAL 113 Ca 0.47 -0.13 -0.18 0.00 0.00 0.00 0.00 61.98 62.14 1ce8 s VAL 113 Cb -0.16 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.11 1ce8 s VAL 113 CO 0.85 0.34 0.46 -0.89 0.00 0.00 0.00 175.10 175.86 1ce8 s THR 114 N 1.55 5.18 -0.39 3.92 2.01 0.50 -4.70 115.64 123.72 1ce8 s THR 114 Ca 0.06 0.90 -0.24 0.00 0.31 0.00 0.00 61.69 62.72 1ce8 s THR 114 Cb -0.15 -3.80 0.02 0.00 0.01 0.00 0.00 72.50 68.58 1ce8 s THR 114 CO 0.04 0.29 0.85 -0.32 -0.69 0.00 0.00 174.62 174.80 1ce8 s MET 115 N 0.87 3.69 0.34 4.92 1.75 -1.26 0.49 119.30 130.11 1ce8 s MET 115 Ca 0.24 0.30 0.08 0.00 -1.25 0.00 0.00 55.69 55.06 1ce8 s MET 115 Cb -0.15 -3.85 -0.04 0.00 2.84 0.00 0.00 34.83 33.64 1ce8 s MET 115 CO 0.09 -0.98 0.18 0.96 -0.65 0.00 0.00 175.02 174.62 1ce8 s ILE 116 N 3.35 3.11 0.00 10.11 -4.36 -0.62 -4.65 121.20 128.15 1ce8 s ILE 116 Ca 0.34 -1.62 0.00 0.00 -0.26 0.00 0.00 60.65 59.11 1ce8 s ILE 116 Cb -0.12 -3.02 0.00 0.00 1.25 0.00 0.00 42.46 40.57 1ce8 s ILE 116 CO 0.20 -0.17 0.00 0.61 0.24 0.00 0.00 174.94 175.82 1ce8 n GLY 117 N -1.21 2.04 2.81 6.27 0.00 -1.26 -4.11 105.19 109.73 1ce8 n GLY 117 Ca -0.03 -0.43 -0.15 0.00 0.00 0.00 0.00 46.02 45.41 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 0.16 0.51 4.61 0.00 -1.26 -4.04 121.76 121.73 1ce8 s ALA 118 Ca 0.00 0.19 -0.18 0.00 0.00 0.00 0.00 51.96 51.97 1ce8 s ALA 118 Cb 0.00 -0.22 -0.08 0.00 0.00 0.00 0.00 23.12 22.82 1ce8 s ALA 118 CO 0.00 -0.07 1.00 0.95 0.00 0.00 0.00 175.76 177.64 1ce8 s THR 119 N 0.81 4.25 0.57 0.00 -4.23 -1.26 -4.85 115.64 110.92 1ce8 s THR 119 Ca -0.07 1.20 0.26 0.00 -1.18 0.00 0.00 61.69 61.90 1ce8 s THR 119 Cb -0.10 -3.59 0.36 0.00 1.34 0.00 0.00 72.50 70.50 1ce8 s THR 119 CO -0.02 -0.50 2.09 0.00 -0.54 0.00 0.00 174.62 175.65 1ce8 h ALA 120 N 1.15 1.97 0.05 3.99 0.00 -1.98 0.48 119.26 124.91 1ce8 h ALA 120 Ca -0.48 -0.01 -0.27 0.00 0.00 0.00 0.00 54.91 54.16 1ce8 h ALA 120 Cb 1.20 0.02 0.02 0.00 0.00 0.00 0.00 17.79 19.02 1ce8 h ALA 120 CO 0.60 -0.32 -1.10 0.22 0.00 0.00 0.00 179.25 178.66 1ce8 h ASP 121 N 0.00 0.74 -0.40 0.00 3.58 -1.96 -2.15 116.42 116.23 1ce8 h ASP 121 Ca 0.11 -0.64 -0.02 0.00 0.42 0.00 0.00 57.03 56.90 1ce8 h ASP 121 Cb 0.52 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 41.32 1ce8 h ASP 121 CO -0.00 1.45 0.19 0.00 -2.88 0.00 0.00 179.24 177.99 1ce8 h ALA 122 N 0.49 0.51 -0.87 -0.78 0.00 -1.17 -0.19 119.26 117.26 1ce8 h ALA 122 Ca -0.13 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 54.71 1ce8 h ALA 122 Cb 1.76 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 19.34 1ce8 h ALA 122 CO 0.20 0.08 0.57 0.82 0.00 0.00 0.00 179.25 180.92 1ce8 h ILE 123 N 0.50 1.12 0.04 0.00 2.04 -1.05 -1.65 117.51 118.51 1ce8 h ILE 123 Ca 0.14 -0.36 -0.22 0.00 1.00 0.00 0.00 64.86 65.41 1ce8 h ILE 123 Cb 0.12 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.16 1ce8 h ILE 123 CO -0.02 0.19 -1.01 -0.78 0.00 0.00 0.00 178.15 176.53 1ce8 h ASP 124 N 1.05 0.20 0.09 1.72 3.58 -1.13 0.71 116.42 122.65 1ce8 h ASP 124 Ca 0.36 -0.19 -0.03 0.00 0.42 0.00 0.00 57.03 57.58 1ce8 h ASP 124 Cb 0.09 -0.06 -0.01 0.00 1.72 0.00 0.00 39.33 41.07 1ce8 h ASP 124 CO -0.12 1.09 -0.12 0.50 -2.88 0.00 0.00 179.24 177.71 1ce8 h LYS 125 N 0.06 0.06 0.11 0.28 3.64 -0.45 0.25 116.57 120.52 1ce8 h LYS 125 Ca -0.05 -0.01 -0.37 0.00 -1.27 0.00 0.00 60.65 58.95 1ce8 h LYS 125 Cb 1.71 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.50 1ce8 h LYS 125 CO 0.15 0.19 -2.05 0.00 -2.27 0.00 0.00 179.45 175.46 1ce8 n ALA 126 N -2.51 0.96 0.09 5.00 0.00 -0.67 -2.56 120.51 120.82 1ce8 n ALA 126 Ca -0.02 -0.65 -0.13 0.00 0.00 0.00 0.00 53.44 52.64 1ce8 n ALA 126 Cb 0.21 -0.61 -0.11 0.00 0.00 0.00 0.00 19.45 18.94 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 0.06 0.21 -6.55 0.00 4.39 -0.70 -3.42 114.58 108.57 1ce8 h GLU 127 Ca -0.44 -0.33 -0.57 0.00 0.34 0.00 0.00 59.36 58.37 1ce8 h GLU 127 Cb 2.02 0.12 -0.06 0.00 -0.10 0.00 0.00 28.75 30.72 1ce8 h GLU 127 CO 0.07 1.13 0.95 0.34 -1.16 0.00 0.00 179.01 180.33 1ce8 s ASP 128 N -7.02 6.64 0.36 1.42 -1.08 0.87 -1.59 116.67 116.25 1ce8 s ASP 128 Ca -0.03 0.75 0.26 0.00 -0.52 0.00 0.00 52.55 53.01 1ce8 s ASP 128 Cb 0.08 -2.55 1.26 0.00 -1.46 0.00 0.00 42.92 40.25 1ce8 s ASP 128 CO 0.86 -1.20 1.78 0.03 0.52 0.00 0.00 175.17 177.17 1ce8 h ARG 129 N 9.31 0.00 -0.02 4.34 3.08 -1.86 -1.15 114.38 128.08 1ce8 h ARG 129 Ca -0.24 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.79 1ce8 h ARG 129 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.12 1ce8 h ARG 129 CO 1.09 0.00 -0.07 -0.09 -1.07 0.00 0.00 179.97 179.82 1ce8 h ARG 130 N 0.00 0.09 -0.42 0.04 2.43 -1.93 -2.76 114.38 111.82 1ce8 h ARG 130 Ca 0.00 -0.07 0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1ce8 h ARG 130 Cb 0.17 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 1ce8 h ARG 130 CO 0.00 0.70 0.27 0.00 -1.51 0.00 0.00 179.97 179.43 1ce8 h ARG 131 N -0.51 0.53 -0.77 0.20 3.08 -1.76 -1.09 114.38 114.05 1ce8 h ARG 131 Ca -0.00 -0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.04 1ce8 h ARG 131 Cb 0.71 -0.12 -0.04 0.00 0.08 0.00 0.00 29.97 30.60 1ce8 h ARG 131 CO 0.02 0.35 0.50 0.35 -1.07 0.00 0.00 179.97 180.12 1ce8 h PHE 132 N 0.55 0.93 -0.65 3.04 3.57 -0.93 -0.89 116.94 122.56 1ce8 h PHE 132 Ca 0.16 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.66 1ce8 h PHE 132 Cb -0.04 -0.31 -0.03 0.00 2.79 0.00 0.00 35.95 38.35 1ce8 h PHE 132 CO -0.05 0.55 0.32 0.22 -2.23 0.00 0.00 178.31 177.12 1ce8 h ASP 133 N 0.98 0.85 -0.56 0.41 3.58 -1.14 -1.83 116.42 118.70 1ce8 h ASP 133 Ca 0.30 -0.13 0.01 0.00 0.42 0.00 0.00 57.03 57.64 1ce8 h ASP 133 Cb -0.02 -0.22 -0.03 0.00 1.72 0.00 0.00 39.33 40.78 1ce8 h ASP 133 CO -0.10 0.73 0.37 0.58 -2.88 0.00 0.00 179.24 177.94 1ce8 h VAL 134 N 0.90 1.12 -0.70 2.25 2.07 -0.34 -2.45 116.25 119.11 1ce8 h VAL 134 Ca 0.22 -0.25 0.05 0.00 0.82 0.00 0.00 66.70 67.54 1ce8 h VAL 134 Cb 0.11 0.32 -0.05 0.00 -1.52 0.00 0.00 31.29 30.14 1ce8 h VAL 134 CO -0.03 0.14 0.41 0.00 0.02 0.00 0.00 177.57 178.10 1ce8 h ALA 135 N 1.22 0.93 -0.45 1.67 0.00 -0.89 0.14 119.26 121.87 1ce8 h ALA 135 Ca 0.21 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1ce8 h ALA 135 Cb -0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1ce8 h ALA 135 CO -0.06 0.11 0.25 0.52 0.00 0.00 0.00 179.25 180.07 1ce8 h MET 136 N 0.75 0.63 -0.70 0.00 2.07 -0.94 -1.52 114.93 115.24 1ce8 h MET 136 Ca 0.31 -0.08 -0.01 0.00 -2.07 0.00 0.00 59.70 57.85 1ce8 h MET 136 Cb 0.15 -0.12 -0.03 0.00 -1.87 0.00 0.00 31.60 29.73 1ce8 h MET 136 CO -0.17 0.51 0.40 -0.22 1.07 0.00 0.00 176.91 178.50 1ce8 h LYS 137 N 0.59 0.95 0.11 1.72 3.64 -0.90 0.43 116.57 123.11 1ce8 h LYS 137 Ca 0.16 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 1ce8 h LYS 137 Cb 0.06 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.68 1ce8 h LYS 137 CO -0.03 0.68 -0.05 -0.22 -2.27 0.00 0.00 179.45 177.56 1ce8 h LYS 138 N 0.96 -0.14 -0.14 1.90 3.64 0.20 -2.24 116.57 120.74 1ce8 h LYS 138 Ca 0.25 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 1ce8 h LYS 138 Cb -0.02 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1ce8 h LYS 138 CO -0.04 -0.08 0.00 0.44 -2.27 0.00 0.00 179.45 177.50 1ce8 n ILE 139 N -5.14 0.08 -2.11 2.00 -5.35 -0.68 -4.86 119.36 103.30 1ce8 n ILE 139 Ca -0.08 -0.07 -0.14 0.00 -0.27 0.00 0.00 62.75 62.19 1ce8 n ILE 139 Cb 0.09 -0.02 -0.02 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 0.52 0.10 3.87 3.28 0.00 -0.56 -5.00 105.19 107.40 1ce8 n GLY 140 Ca 0.02 -0.30 -0.35 0.00 0.00 0.00 0.00 46.02 45.39 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 -3.93 4.36 0.21 0.99 1.43 0.14 -4.97 118.68 116.91 1ce8 s LEU 141 Ca 0.00 0.69 -0.23 0.00 -1.03 0.00 0.00 54.13 53.57 1ce8 s LEU 141 Cb 0.00 -2.86 -0.08 0.00 0.03 0.00 0.00 46.19 43.28 1ce8 s LEU 141 CO 0.00 0.21 0.77 -0.70 0.23 0.00 0.00 176.35 176.85 1ce8 s GLU 142 N -1.85 4.41 0.13 1.70 2.12 -1.26 -4.05 118.70 119.90 1ce8 s GLU 142 Ca 0.31 1.03 0.03 0.00 0.36 0.00 0.00 54.97 56.70 1ce8 s GLU 142 Cb -0.14 -3.02 -0.04 0.00 0.26 0.00 0.00 34.13 31.19 1ce8 s GLU 142 CO 0.17 0.45 -0.08 0.95 -0.54 0.00 0.00 175.26 176.21 1ce8 s THR 143 N -1.39 0.96 0.73 -1.70 -4.23 -1.26 0.39 115.64 109.14 1ce8 s THR 143 Ca 0.41 -2.01 -0.12 0.00 -1.18 0.00 0.00 61.69 58.79 1ce8 s THR 143 Cb -0.19 -1.80 0.03 0.00 1.34 0.00 0.00 72.50 71.88 1ce8 s THR 143 CO 0.23 -0.78 1.09 0.00 -0.54 0.00 0.00 174.62 174.62 1ce8 s ALA 144 N -3.46 2.39 0.11 3.99 0.00 -1.26 -4.94 121.76 118.59 1ce8 s ALA 144 Ca 0.15 0.31 -0.31 0.00 0.00 0.00 0.00 51.96 52.12 1ce8 s ALA 144 Cb 0.04 -3.27 -0.10 0.00 0.00 0.00 0.00 23.12 19.79 1ce8 s ALA 144 CO -0.01 -1.53 1.81 0.50 0.00 0.00 0.00 175.76 176.53 1ce8 s ARG 145 N -4.69 4.15 0.30 0.00 3.52 -1.26 -4.84 118.95 116.13 1ce8 s ARG 145 Ca 0.62 2.55 -0.04 0.00 -0.13 0.00 0.00 55.73 58.74 1ce8 s ARG 145 Cb -0.17 -3.65 -0.01 0.00 -1.56 0.00 0.00 34.95 29.56 1ce8 s ARG 145 CO 0.51 -0.84 0.41 -1.54 -0.81 0.00 0.00 175.30 173.04 1ce8 s SER 146 N 2.82 0.66 -0.21 -2.12 1.04 -1.26 -0.27 113.70 114.36 1ce8 s SER 146 Ca 0.80 -1.38 -0.20 0.00 0.48 0.00 0.00 55.95 55.65 1ce8 s SER 146 Cb -0.45 0.60 0.06 0.00 0.10 0.00 0.00 66.02 66.33 1ce8 s SER 146 CO 0.36 -1.19 0.57 -0.83 0.98 0.00 0.00 173.24 173.14 1ce8 s GLY 147 N -3.19 -0.43 0.18 7.32 0.00 -0.39 -4.96 107.32 105.86 1ce8 s GLY 147 Ca 0.31 1.61 -0.21 0.00 0.00 0.00 0.00 44.72 46.43 1ce8 s GLY 147 CO 0.17 1.39 0.71 -0.42 0.00 0.00 0.00 173.10 174.96 1ce8 s ILE 148 N 0.30 4.55 -0.02 0.90 -1.09 -1.26 -1.10 121.20 123.47 1ce8 s ILE 148 Ca -0.00 1.38 -0.00 0.00 -2.23 0.00 0.00 60.65 59.79 1ce8 s ILE 148 Cb -0.04 -3.94 0.02 0.00 -1.58 0.00 0.00 42.46 36.93 1ce8 s ILE 148 CO 0.01 0.34 0.03 0.00 -1.23 0.00 0.00 174.94 174.10 1ce8 s ALA 149 N -1.36 0.02 -0.62 9.38 0.00 -0.41 -4.76 121.76 124.01 1ce8 s ALA 149 Ca 0.39 0.27 0.09 0.00 0.00 0.00 0.00 51.96 52.70 1ce8 s ALA 149 Cb -0.19 -0.21 -0.05 0.00 0.00 0.00 0.00 23.12 22.68 1ce8 s ALA 149 CO 0.22 -0.09 0.48 0.72 0.00 0.00 0.00 175.76 177.10 1ce8 n HIS 150 N 3.89 0.00 -4.10 0.00 8.25 -1.26 -2.28 115.22 119.72 1ce8 n HIS 150 Ca -0.24 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.12 1ce8 n HIS 150 Cb 0.53 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.56 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 -1.54 0.02 0.43 1.59 -4.23 -1.26 -4.93 115.64 105.72 1ce8 s THR 151 Ca 0.05 -1.72 0.15 0.00 -1.18 0.00 0.00 61.69 58.99 1ce8 s THR 151 Cb 0.07 -2.26 0.18 0.00 1.34 0.00 0.00 72.50 71.82 1ce8 s THR 151 CO 0.29 -0.09 1.97 -0.03 -0.54 0.00 0.00 174.62 176.22 1ce8 h MET 152 N 2.53 0.00 0.32 3.99 4.05 -1.96 0.21 114.93 124.08 1ce8 h MET 152 Ca -0.32 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.08 1ce8 h MET 152 Cb 1.24 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.04 1ce8 h MET 152 CO 0.48 0.21 -0.16 1.49 0.23 0.00 0.00 176.91 179.16 1ce8 h GLU 153 N 0.00 -0.42 -0.43 0.39 4.81 -1.99 0.66 114.58 117.60 1ce8 h GLU 153 Ca -0.00 0.03 0.09 0.00 -0.13 0.00 0.00 59.36 59.34 1ce8 h GLU 153 Cb 0.38 0.10 -0.09 0.00 0.63 0.00 0.00 28.75 29.76 1ce8 h GLU 153 CO 0.03 -0.11 -0.29 0.93 -0.73 0.00 0.00 179.01 178.83 1ce8 h GLU 154 N -0.74 -0.20 -0.19 1.92 5.08 -1.80 -2.29 114.58 116.36 1ce8 h GLU 154 Ca -0.04 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.37 1ce8 h GLU 154 Cb 0.50 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.75 1ce8 h GLU 154 CO 0.07 -0.13 -0.08 0.00 -1.00 0.00 0.00 179.01 177.87 1ce8 h ALA 155 N 0.91 0.09 0.00 3.43 0.00 -0.46 -1.95 119.26 121.28 1ce8 h ALA 155 Ca 0.19 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1ce8 h ALA 155 Cb 0.52 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 1ce8 h ALA 155 CO -0.54 -0.51 -0.07 -0.07 0.00 0.00 0.00 179.25 178.06 1ce8 h LEU 156 N -0.05 0.00 -0.69 0.00 3.38 -0.36 -0.74 115.31 116.86 1ce8 h LEU 156 Ca 0.10 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.95 1ce8 h LEU 156 Cb 0.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1ce8 h LEU 156 CO -0.23 0.07 -0.33 0.00 0.09 0.00 0.00 178.44 178.04 1ce8 h ALA 157 N 1.93 0.86 -0.21 1.53 0.00 -0.83 -1.97 119.26 120.58 1ce8 h ALA 157 Ca -0.00 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 1ce8 h ALA 157 Cb 0.14 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1ce8 h ALA 157 CO 0.01 0.63 0.07 0.28 0.00 0.00 0.00 179.25 180.24 1ce8 h VAL 158 N 0.55 1.19 -0.73 0.00 2.07 -0.89 -2.50 116.25 115.94 1ce8 h VAL 158 Ca 0.06 -0.59 0.11 0.00 0.82 0.00 0.00 66.70 67.10 1ce8 h VAL 158 Cb 0.83 1.18 -0.05 0.00 -1.52 0.00 0.00 31.29 31.74 1ce8 h VAL 158 CO 0.07 0.19 0.48 0.00 0.02 0.00 0.00 177.57 178.33 1ce8 h ALA 159 N 0.89 1.93 -0.12 1.67 0.00 -1.18 0.45 119.26 122.91 1ce8 h ALA 159 Ca 0.07 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1ce8 h ALA 159 Cb 0.23 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1ce8 h ALA 159 CO -0.00 -0.10 -0.29 0.00 0.00 0.00 0.00 179.25 178.86 1ce8 h ALA 160 N 1.64 1.30 0.08 0.00 0.00 -0.97 0.21 119.26 121.52 1ce8 h ALA 160 Ca 0.34 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ce8 h ALA 160 Cb 0.59 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1ce8 h ALA 160 CO -0.12 0.48 -0.04 0.22 0.00 0.00 0.00 179.25 179.79 1ce8 h ASP 161 N 0.19 -0.10 1.20 0.00 3.58 0.03 -3.37 116.42 117.95 1ce8 h ASP 161 Ca 0.03 -0.23 -0.07 0.00 0.42 0.00 0.00 57.03 57.17 1ce8 h ASP 161 Cb 0.62 0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.68 1ce8 h ASP 161 CO 0.04 0.49 -0.35 -0.37 -2.88 0.00 0.00 179.24 176.18 1ce8 h VAL 162 N -1.00 0.70 -0.94 2.25 -1.51 -0.36 -3.50 116.25 111.89 1ce8 h VAL 162 Ca -0.01 -1.62 0.10 0.00 -1.23 0.00 0.00 66.70 63.94 1ce8 h VAL 162 Cb 0.33 2.07 -0.04 0.00 -2.13 0.00 0.00 31.29 31.51 1ce8 h VAL 162 CO 0.02 0.34 -0.28 0.61 -1.23 0.00 0.00 177.57 177.03 1ce8 n GLY 163 N 0.65 -2.31 3.88 5.19 0.00 0.75 -4.76 105.19 108.60 1ce8 n GLY 163 Ca 0.01 -1.38 -0.34 0.00 0.00 0.00 0.00 46.02 44.31 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 -2.60 3.57 0.73 1.61 0.08 -1.26 -3.52 117.98 116.59 1ce8 s PHE 164 Ca 0.00 0.58 -0.11 0.00 0.12 0.00 0.00 56.93 57.52 1ce8 s PHE 164 Cb 0.00 -2.00 0.03 0.00 -0.57 0.00 0.00 43.02 40.48 1ce8 s PHE 164 CO 0.00 0.60 1.08 -1.25 -0.10 0.00 0.00 175.22 175.55 1ce8 s PRO 165 N -1.83 2.63 0.02 0.24 0.04 -1.26 -5.04 135.00 129.80 1ce8 s PRO 165 Ca 0.29 0.69 -0.03 0.00 0.04 0.00 0.00 61.00 61.98 1ce8 s PRO 165 Cb -0.13 -1.98 -0.01 0.00 0.04 0.00 0.00 34.50 32.42 1ce8 s PRO 165 CO 0.17 -1.25 0.03 0.00 0.04 0.00 0.00 177.00 176.00 1ce8 s ILE 167 N -1.53 5.42 -0.25 0.00 1.09 0.41 -0.42 121.20 125.92 1ce8 s ILE 167 Ca -0.15 0.20 -0.06 0.00 -1.10 0.00 0.00 60.65 59.54 1ce8 s ILE 167 Cb -0.08 -3.46 -0.01 0.00 -1.06 0.00 0.00 42.46 37.84 1ce8 s ILE 167 CO -0.00 0.46 0.03 -0.63 -0.10 0.00 0.00 174.94 174.69 1ce8 s ILE 168 N 0.19 3.85 -0.11 2.92 1.01 -0.49 0.29 121.20 128.87 1ce8 s ILE 168 Ca 0.09 -0.42 -0.01 0.00 0.00 0.00 0.00 60.65 60.31 1ce8 s ILE 168 Cb -0.11 -2.82 0.03 0.00 0.01 0.00 0.00 42.46 39.56 1ce8 s ILE 168 CO -0.01 0.32 -0.04 -0.13 0.00 0.00 0.00 174.94 175.08 1ce8 s ARG 169 N 1.53 1.10 0.40 2.79 0.52 0.11 -2.35 118.95 123.04 1ce8 s ARG 169 Ca 0.05 -0.15 -0.23 0.00 -0.52 0.00 0.00 55.73 54.88 1ce8 s ARG 169 Cb -0.15 -1.42 -0.09 0.00 0.52 0.00 0.00 34.95 33.80 1ce8 s ARG 169 CO 0.01 -0.32 1.01 -2.14 0.02 0.00 0.00 175.30 173.88 1ce8 s PRO 170 N 1.82 4.20 0.44 3.54 0.02 -1.26 0.18 135.00 143.93 1ce8 s PRO 170 Ca 0.04 1.40 -0.21 0.00 0.02 0.00 0.00 61.00 62.24 1ce8 s PRO 170 Cb -0.13 -2.47 -0.10 0.00 0.02 0.00 0.00 34.50 31.82 1ce8 s PRO 170 CO -0.07 -0.09 1.00 -1.12 -0.33 0.00 0.00 177.00 176.39 1ce8 s SER 171 N -1.73 6.70 -1.47 2.53 0.01 0.54 -3.72 113.70 116.56 1ce8 s SER 171 Ca 0.58 1.84 0.00 0.00 1.31 0.00 0.00 55.95 59.68 1ce8 s SER 171 Cb -0.19 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.49 1ce8 s SER 171 CO 0.23 -0.53 0.00 0.49 0.41 0.00 0.00 173.24 173.85 1ce8 n PHE 172 N -0.63 -0.22 -4.34 2.43 3.01 -0.62 -4.15 117.46 112.93 1ce8 n PHE 172 Ca 0.07 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.35 1ce8 n PHE 172 Cb 0.53 -2.77 -0.10 0.00 -0.01 0.00 0.00 39.48 37.12 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 -2.61 1.47 0.23 4.37 -4.23 -1.24 -4.56 115.64 109.07 1ce8 s THR 173 Ca 0.00 -2.13 -0.04 0.00 -1.18 0.00 0.00 61.69 58.34 1ce8 s THR 173 Cb 0.00 -2.14 -0.03 0.00 1.34 0.00 0.00 72.50 71.67 1ce8 s THR 173 CO 0.00 -0.52 0.26 0.00 -0.54 0.00 0.00 174.62 173.82 1ce8 s MET 174 N -3.72 1.38 -1.62 3.99 0.23 -1.26 -4.88 119.30 113.41 1ce8 s MET 174 Ca 0.24 -1.56 0.00 0.00 -1.03 0.00 0.00 55.69 53.34 1ce8 s MET 174 Cb 0.02 0.34 0.00 0.00 -1.53 0.00 0.00 34.83 33.66 1ce8 s MET 174 CO 0.07 -0.50 0.00 0.41 -2.03 0.00 0.00 175.02 172.96 1ce8 n GLY 175 N -0.34 1.52 2.35 3.16 0.00 -1.26 -1.71 105.19 108.91 1ce8 n GLY 175 Ca 0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 46.02 45.85 1ce8 n GLY 175 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ce8 n GLY 176 N -0.71 0.45 3.68 -0.02 0.00 -1.25 -0.94 105.19 106.39 1ce8 n GLY 176 Ca -0.15 -0.14 -0.47 0.00 0.00 0.00 0.00 46.02 45.26 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 -0.16 3.42 0.00 1.61 7.64 -0.70 -0.51 113.62 124.92 1ce8 n SER 177 Ca -0.02 1.00 0.00 0.00 1.01 0.00 0.00 58.87 60.87 1ce8 n SER 177 Cb 0.21 -1.40 0.00 0.00 -1.01 0.00 0.00 64.21 62.00 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 4.11 0.85 2.55 0.23 0.00 -1.26 -4.67 105.19 107.00 1ce8 n GLY 178 Ca 0.21 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.26 2.72 0.00 -0.02 0.00 0.33 -3.28 105.19 102.67 1ce8 n GLY 179 Ca 0.00 -2.25 0.00 0.00 0.00 0.00 0.00 46.02 43.77 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 0.54 -1.76 3.48 -0.02 0.00 -0.99 -4.48 105.19 101.95 1ce8 n GLY 180 Ca 0.00 -1.12 -0.33 0.00 0.00 0.00 0.00 46.02 44.57 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 -2.44 3.56 -0.20 -0.61 1.01 -1.26 -1.39 121.20 119.86 1ce8 s ILE 181 Ca 0.00 -0.50 -0.05 0.00 0.00 0.00 0.00 60.65 60.10 1ce8 s ILE 181 Cb 0.00 -2.51 -0.02 0.00 0.01 0.00 0.00 42.46 39.94 1ce8 s ILE 181 CO 0.00 0.53 0.00 0.00 0.00 0.00 0.00 174.94 175.48 1ce8 s ALA 182 N 0.02 3.04 -0.25 9.38 0.00 0.44 -4.91 121.76 129.47 1ce8 s ALA 182 Ca -0.01 -0.99 0.22 0.00 0.00 0.00 0.00 51.96 51.18 1ce8 s ALA 182 Cb -0.14 -1.78 -0.07 0.00 0.00 0.00 0.00 23.12 21.14 1ce8 s ALA 182 CO 0.03 -0.15 0.91 0.66 0.00 0.00 0.00 175.76 177.21 1ce8 n TYR 183 N 4.25 0.62 -4.00 0.00 4.01 -1.26 -2.33 117.16 118.46 1ce8 n TYR 183 Ca -0.17 0.18 -0.10 0.00 -0.16 0.00 0.00 57.90 57.66 1ce8 n TYR 183 Cb 0.52 -0.77 -0.05 0.00 -0.31 0.00 0.00 39.34 38.73 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 -4.92 -0.01 0.26 7.72 2.20 -1.26 -4.78 114.94 114.15 1ce8 s ASN 184 Ca -0.02 -0.99 -0.02 0.00 -0.94 0.00 0.00 52.86 50.90 1ce8 s ASN 184 Cb 0.11 0.60 0.45 0.00 -2.00 0.00 0.00 41.25 40.42 1ce8 s ASN 184 CO 0.82 -1.17 1.83 -0.09 -2.94 0.00 0.00 177.10 175.55 1ce8 h ARG 185 N 2.24 0.87 -0.60 3.55 2.43 -1.98 0.20 114.38 121.08 1ce8 h ARG 185 Ca -0.26 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 58.77 1ce8 h ARG 185 Cb 1.25 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 30.58 1ce8 h ARG 185 CO 0.36 0.58 0.06 1.49 -1.51 0.00 0.00 179.97 180.95 1ce8 h GLU 186 N 0.90 1.02 -0.16 0.20 4.81 -2.00 0.34 114.58 119.70 1ce8 h GLU 186 Ca 0.44 -0.29 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 1ce8 h GLU 186 Cb 0.39 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.65 1ce8 h GLU 186 CO -0.25 0.98 -0.05 0.93 -0.73 0.00 0.00 179.01 179.89 1ce8 h GLU 187 N 0.93 0.31 -0.16 1.92 5.08 -1.82 -2.95 114.58 117.88 1ce8 h GLU 187 Ca 0.18 -0.12 0.03 0.00 -1.00 0.00 0.00 59.36 58.45 1ce8 h GLU 187 Cb 0.47 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.65 1ce8 h GLU 187 CO 0.02 0.60 -0.48 0.35 -1.00 0.00 0.00 179.01 178.50 1ce8 h PHE 188 N 0.00 -1.44 -0.79 4.33 3.57 -0.34 -0.50 116.94 121.78 1ce8 h PHE 188 Ca 0.04 0.06 0.16 0.00 3.53 0.00 0.00 57.97 61.75 1ce8 h PHE 188 Cb 0.49 0.65 -0.10 0.00 2.79 0.00 0.00 35.95 39.77 1ce8 h PHE 188 CO 0.06 -0.47 0.31 0.93 -2.23 0.00 0.00 178.31 176.91 1ce8 h GLU 189 N -0.48 0.42 0.11 1.11 5.08 -0.98 -1.43 114.58 118.41 1ce8 h GLU 189 Ca 0.03 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1ce8 h GLU 189 Cb 0.58 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1ce8 h GLU 189 CO -0.41 0.28 -0.05 1.49 -1.00 0.00 0.00 179.01 179.31 1ce8 h GLU 190 N 0.43 -0.15 -0.65 2.33 4.81 -1.23 -1.01 114.58 119.11 1ce8 h GLU 190 Ca 0.45 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.61 1ce8 h GLU 190 Cb 0.72 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.11 1ce8 h GLU 190 CO -0.44 -0.01 0.11 0.82 -0.73 0.00 0.00 179.01 178.76 1ce8 h ILE 191 N -0.25 1.26 -0.36 2.32 2.04 -0.69 -2.47 117.51 119.36 1ce8 h ILE 191 Ca -0.02 -1.01 -0.05 0.00 1.00 0.00 0.00 64.86 64.78 1ce8 h ILE 191 Cb 0.20 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 1ce8 h ILE 191 CO 0.03 0.38 0.02 0.00 0.00 0.00 0.00 178.15 178.58 1ce8 h ALA 193 N 0.88 0.53 -0.45 0.00 0.00 -1.13 0.37 119.26 119.46 1ce8 h ALA 193 Ca 0.10 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ce8 h ALA 193 Cb 0.42 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1ce8 h ALA 193 CO 0.01 0.00 0.22 -0.09 0.00 0.00 0.00 179.25 179.40 1ce8 h ARG 194 N 0.56 0.64 -0.41 0.00 2.43 -1.22 -2.72 114.38 113.65 1ce8 h ARG 194 Ca 0.15 -0.09 -0.06 0.00 -0.81 0.00 0.00 59.98 59.17 1ce8 h ARG 194 Cb -0.04 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 1ce8 h ARG 194 CO -0.03 0.54 0.00 0.78 -1.51 0.00 0.00 179.97 179.75 1ce8 h GLY 195 N 0.58 0.78 0.88 2.80 0.00 -0.04 -1.99 103.07 106.08 1ce8 h GLY 195 Ca 0.15 -0.57 0.04 0.00 0.00 0.00 0.00 47.33 46.95 1ce8 h GLY 195 CO -0.02 0.53 0.65 1.41 0.00 0.00 0.00 176.54 179.11 1ce8 h LEU 196 N 0.55 1.08 0.00 3.11 3.38 -0.18 0.22 115.31 123.47 1ce8 h LEU 196 Ca 0.12 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1ce8 h LEU 196 Cb 0.48 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1ce8 h LEU 196 CO 0.02 0.74 -0.09 -0.78 0.09 0.00 0.00 178.44 178.42 1ce8 h ASP 197 N 1.25 0.00 0.16 -0.43 3.58 -1.46 -3.30 116.42 116.23 1ce8 h ASP 197 Ca 0.40 -0.03 -0.36 0.00 0.42 0.00 0.00 57.03 57.47 1ce8 h ASP 197 Cb 0.02 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.02 1ce8 h ASP 197 CO -0.13 0.01 -2.10 -0.11 -2.88 0.00 0.00 179.24 174.04 1ce8 n LEU 198 N -2.34 2.02 -4.68 2.28 7.94 -0.69 -4.90 117.00 116.62 1ce8 n LEU 198 Ca 0.05 0.15 -0.44 0.00 -1.11 0.00 0.00 56.01 54.65 1ce8 n LEU 198 Cb 0.44 -0.60 -0.04 0.00 0.53 0.00 0.00 43.42 43.76 1ce8 n LEU 198 CO 0.32 0.73 1.41 -0.24 -1.11 0.00 0.00 177.39 178.50 1ce8 n SER 199 N -3.25 3.70 0.27 1.96 2.88 0.70 -4.86 113.62 115.02 1ce8 n SER 199 Ca -0.32 1.01 0.18 0.00 -1.33 0.00 0.00 58.87 58.41 1ce8 n SER 199 Cb 1.05 -1.48 0.88 0.00 -0.75 0.00 0.00 64.21 63.91 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 8.06 0.00 -0.31 -1.46 0.11 -1.80 -0.13 132.00 136.47 1ce8 h PRO 200 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1ce8 h PRO 200 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1ce8 h PRO 200 CO 0.93 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.97 1ce8 n THR 201 N -2.89 0.84 -3.81 -1.15 -2.24 -1.26 -4.98 114.28 98.79 1ce8 n THR 201 Ca -0.01 -0.92 -0.32 0.00 -2.27 0.00 0.00 64.05 60.53 1ce8 n THR 201 Cb 0.16 0.62 0.02 0.00 -2.10 0.00 0.00 70.33 69.04 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 0.59 -1.65 -3.90 -0.78 4.81 -0.06 -4.97 118.16 112.21 1ce8 n LYS 202 Ca 0.11 0.39 -0.11 0.00 -0.87 0.00 0.00 58.31 57.84 1ce8 n LYS 202 Cb 0.41 -4.01 -0.10 0.00 0.02 0.00 0.00 35.03 31.35 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 -6.33 0.41 0.04 1.64 2.12 -1.26 -4.71 118.70 110.60 1ce8 s GLU 203 Ca 0.35 -0.40 0.03 0.00 0.36 0.00 0.00 54.97 55.31 1ce8 s GLU 203 Cb -0.14 0.17 -0.02 0.00 0.26 0.00 0.00 34.13 34.40 1ce8 s GLU 203 CO 0.88 -0.09 -0.10 -0.51 -0.54 0.00 0.00 175.26 174.90 1ce8 s LEU 204 N -1.28 2.20 -0.13 2.70 1.43 -0.97 -0.34 118.68 122.30 1ce8 s LEU 204 Ca -0.14 -0.46 0.01 0.00 -1.03 0.00 0.00 54.13 52.51 1ce8 s LEU 204 Cb -0.08 -0.37 -0.01 0.00 0.03 0.00 0.00 46.19 45.76 1ce8 s LEU 204 CO 0.01 -0.07 -0.16 -0.22 0.23 0.00 0.00 176.35 176.14 1ce8 s LEU 205 N -1.25 2.51 -0.15 1.79 2.96 0.47 -1.28 118.68 123.72 1ce8 s LEU 205 Ca -0.03 -0.41 0.01 0.00 -0.22 0.00 0.00 54.13 53.47 1ce8 s LEU 205 Cb -0.08 -1.55 -0.00 0.00 0.50 0.00 0.00 46.19 45.06 1ce8 s LEU 205 CO 0.01 0.15 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.40 1ce8 s ILE 206 N 0.41 2.56 0.13 6.68 1.01 -0.26 0.05 121.20 131.79 1ce8 s ILE 206 Ca -0.12 -0.81 0.10 0.00 0.00 0.00 0.00 60.65 59.82 1ce8 s ILE 206 Cb -0.16 -2.07 -0.04 0.00 0.01 0.00 0.00 42.46 40.20 1ce8 s ILE 206 CO 0.06 0.52 -0.25 -1.81 0.00 0.00 0.00 174.94 173.46 1ce8 s ASP 207 N 0.78 3.16 0.93 3.58 1.11 0.15 -1.26 116.67 125.12 1ce8 s ASP 207 Ca -0.06 -0.76 -0.11 0.00 0.18 0.00 0.00 52.55 51.81 1ce8 s ASP 207 Cb -0.15 -0.21 0.15 0.00 1.07 0.00 0.00 42.92 43.78 1ce8 s ASP 207 CO 0.00 0.14 1.12 -1.83 1.18 0.00 0.00 175.17 175.78 1ce8 s GLU 208 N -2.13 0.90 0.14 8.23 -1.05 0.63 -0.44 118.70 124.98 1ce8 s GLU 208 Ca 0.13 1.35 -0.30 0.00 -0.15 0.00 0.00 54.97 56.01 1ce8 s GLU 208 Cb -0.10 -1.73 -0.07 0.00 -0.44 0.00 0.00 34.13 31.80 1ce8 s GLU 208 CO 0.06 -2.64 1.02 0.45 0.95 0.00 0.00 175.26 175.10 1ce8 s SER 209 N -2.79 7.40 -0.09 0.83 0.15 -1.23 -4.57 113.70 113.41 1ce8 s SER 209 Ca 0.66 1.92 0.12 0.00 0.70 0.00 0.00 55.95 59.35 1ce8 s SER 209 Cb -0.22 -2.59 0.19 0.00 -1.71 0.00 0.00 66.02 61.69 1ce8 s SER 209 CO 0.59 -0.13 1.10 0.18 1.20 0.00 0.00 173.24 176.17 1ce8 n LEU 210 N 2.64 1.54 -4.70 3.45 4.77 -1.26 -5.07 117.00 118.37 1ce8 n LEU 210 Ca 0.03 -2.37 -0.43 0.00 -0.03 0.00 0.00 56.01 53.21 1ce8 n LEU 210 Cb 0.48 -0.28 -0.01 0.00 -2.33 0.00 0.00 43.42 41.28 1ce8 n LEU 210 CO 0.52 0.55 0.92 -0.38 -1.33 0.00 0.00 177.39 177.68 1ce8 n ILE 211 N -0.94 1.85 0.00 -0.08 5.41 -1.26 -1.75 119.36 122.59 1ce8 n ILE 211 Ca 0.10 -0.46 0.00 0.00 1.00 0.00 0.00 62.75 63.39 1ce8 n ILE 211 Cb 0.66 -1.57 0.00 0.00 -0.71 0.00 0.00 39.64 38.03 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 0.97 2.47 3.77 7.39 0.00 -0.57 -4.94 105.19 114.27 1ce8 n GLY 212 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.24 2.61 0.40 1.61 0.52 -0.72 -4.69 118.94 116.44 1ce8 s TRP 213 Ca 0.00 1.39 -0.24 0.00 0.02 0.00 0.00 56.10 57.27 1ce8 s TRP 213 Cb 0.00 -3.07 -0.09 0.00 -1.15 0.00 0.00 33.47 29.17 1ce8 s TRP 213 CO 0.00 -1.89 1.07 0.15 0.02 0.00 0.00 176.95 176.31 1ce8 s LYS 214 N -4.97 4.14 -0.12 4.98 1.02 0.25 -1.09 119.74 123.96 1ce8 s LYS 214 Ca 0.61 1.58 0.03 0.00 0.02 0.00 0.00 55.97 58.20 1ce8 s LYS 214 Cb -0.17 -2.57 -0.00 0.00 -0.52 0.00 0.00 37.83 34.57 1ce8 s LYS 214 CO 0.56 -0.17 -0.21 -2.00 -0.92 0.00 0.00 175.35 172.61 1ce8 s GLU 215 N -2.44 3.12 0.14 1.68 2.12 -1.26 -0.74 118.70 121.31 1ce8 s GLU 215 Ca 0.58 -0.83 0.07 0.00 0.36 0.00 0.00 54.97 55.14 1ce8 s GLU 215 Cb -0.24 -2.42 -0.04 0.00 0.26 0.00 0.00 34.13 31.69 1ce8 s GLU 215 CO 0.30 0.12 -0.15 0.71 -0.54 0.00 0.00 175.26 175.70 1ce8 s TYR 216 N 0.51 1.52 0.06 5.30 2.02 -0.58 -0.48 117.35 125.69 1ce8 s TYR 216 Ca -0.13 -0.54 0.02 0.00 -0.37 0.00 0.00 57.07 56.04 1ce8 s TYR 216 Cb -0.17 -0.78 -0.03 0.00 -0.40 0.00 0.00 41.96 40.58 1ce8 s TYR 216 CO 0.05 0.20 -0.07 -1.21 -1.57 0.00 0.00 175.55 172.95 1ce8 s GLU 217 N -2.80 0.61 -0.02 -0.62 2.02 -0.76 -0.27 118.70 116.86 1ce8 s GLU 217 Ca 0.12 -0.93 -0.00 0.00 0.02 0.00 0.00 54.97 54.17 1ce8 s GLU 217 Cb -0.05 -0.24 0.02 0.00 0.10 0.00 0.00 34.13 33.96 1ce8 s GLU 217 CO 0.04 0.02 0.03 -1.64 0.02 0.00 0.00 175.26 173.74 1ce8 s MET 218 N -2.29 -0.01 -0.37 1.61 -1.94 -0.06 -0.69 119.30 115.56 1ce8 s MET 218 Ca -0.03 0.14 -0.14 0.00 -1.71 0.00 0.00 55.69 53.95 1ce8 s MET 218 Cb -0.05 -0.15 -0.00 0.00 2.01 0.00 0.00 34.83 36.64 1ce8 s MET 218 CO -0.01 -0.11 0.27 -1.21 -0.01 0.00 0.00 175.02 173.94 1ce8 s GLU 219 N 0.69 3.28 0.21 2.03 0.41 -0.81 -0.80 118.70 123.71 1ce8 s GLU 219 Ca -0.06 -0.80 0.09 0.00 -0.41 0.00 0.00 54.97 53.79 1ce8 s GLU 219 Cb -0.08 -3.88 -0.04 0.00 -1.78 0.00 0.00 34.13 28.35 1ce8 s GLU 219 CO -0.02 -0.57 -0.03 0.08 -0.49 0.00 0.00 175.26 174.23 1ce8 s VAL 220 N 1.71 3.45 -0.02 2.63 1.01 -0.28 -0.21 120.40 128.68 1ce8 s VAL 220 Ca 0.06 -1.68 -0.00 0.00 0.00 0.00 0.00 61.98 60.36 1ce8 s VAL 220 Cb -0.18 -2.76 0.03 0.00 0.00 0.00 0.00 36.38 33.46 1ce8 s VAL 220 CO 0.10 -0.21 0.03 -0.69 0.00 0.00 0.00 175.10 174.33 1ce8 s VAL 221 N -1.94 -0.02 0.02 2.92 1.01 0.68 -1.19 120.40 121.88 1ce8 s VAL 221 Ca 0.28 0.21 0.04 0.00 0.00 0.00 0.00 61.98 62.51 1ce8 s VAL 221 Cb -0.08 -0.11 -0.02 0.00 0.00 0.00 0.00 36.38 36.17 1ce8 s VAL 221 CO 0.18 0.10 -0.13 -0.60 0.00 0.00 0.00 175.10 174.65 1ce8 s ARG 222 N 1.11 0.92 0.44 2.72 3.52 -0.85 0.11 118.95 126.93 1ce8 s ARG 222 Ca -0.09 -0.64 0.06 0.00 -0.13 0.00 0.00 55.73 54.94 1ce8 s ARG 222 Cb -0.13 -0.90 -0.04 0.00 -1.56 0.00 0.00 34.95 32.32 1ce8 s ARG 222 CO -0.03 0.23 0.15 0.16 -0.81 0.00 0.00 175.30 175.00 1ce8 s ASP 223 N -0.86 4.31 0.63 -2.12 1.47 0.80 -1.85 116.67 119.05 1ce8 s ASP 223 Ca 0.02 -1.23 0.36 0.00 1.18 0.00 0.00 52.55 52.89 1ce8 s ASP 223 Cb -0.07 -0.23 2.08 0.00 -0.34 0.00 0.00 42.92 44.36 1ce8 s ASP 223 CO 0.01 -0.63 2.27 0.07 0.68 0.00 0.00 175.17 177.57 1ce8 h LYS 224 N 1.40 0.00 -0.05 2.11 2.10 -1.68 0.54 116.57 121.00 1ce8 h LYS 224 Ca -0.43 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.22 1ce8 h LYS 224 Cb 1.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 1ce8 h LYS 224 CO 0.71 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 178.25 1ce8 n ASN 225 N -3.44 1.02 -0.07 7.07 3.02 -1.26 -4.85 115.26 116.74 1ce8 n ASN 225 Ca -0.02 -1.43 -0.01 0.00 -0.03 0.00 0.00 54.58 53.09 1ce8 n ASN 225 Cb 0.12 -0.02 -0.00 0.00 -0.61 0.00 0.00 39.78 39.26 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 -0.17 -3.16 -4.75 6.41 2.03 0.19 -4.99 116.55 112.10 1ce8 n ASP 226 Ca 0.19 0.02 -0.40 0.00 0.52 0.00 0.00 54.79 55.12 1ce8 n ASP 226 Cb 0.26 -0.74 -0.05 0.00 -0.72 0.00 0.00 41.12 39.86 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 -2.72 7.47 -0.08 1.67 0.01 -1.24 -4.79 114.94 115.26 1ce8 s ASN 227 Ca 0.00 2.06 -0.03 0.00 -0.71 0.00 0.00 52.86 54.18 1ce8 s ASN 227 Cb 0.00 -2.61 0.04 0.00 0.41 0.00 0.00 41.25 39.09 1ce8 s ASN 227 CO 0.00 0.00 0.17 0.00 -1.51 0.00 0.00 177.10 175.76 1ce8 s ILE 229 N 1.35 1.35 -0.40 0.00 -4.36 0.31 -4.95 121.20 114.50 1ce8 s ILE 229 Ca -0.08 -1.58 -0.17 0.00 -0.26 0.00 0.00 60.65 58.56 1ce8 s ILE 229 Cb -0.11 -1.42 0.01 0.00 1.25 0.00 0.00 42.46 42.19 1ce8 s ILE 229 CO -0.07 -0.30 0.46 -0.63 0.24 0.00 0.00 174.94 174.65 1ce8 s ILE 230 N -1.73 5.06 0.11 8.37 -1.09 -1.26 -0.23 121.20 130.43 1ce8 s ILE 230 Ca 0.06 -0.11 -0.04 0.00 -2.23 0.00 0.00 60.65 58.32 1ce8 s ILE 230 Cb -0.07 -4.01 -0.22 0.00 -1.58 0.00 0.00 42.46 36.58 1ce8 s ILE 230 CO 0.03 -0.35 1.25 0.58 -1.23 0.00 0.00 174.94 175.22 1ce8 h VAL 231 N 5.69 1.43 -1.90 2.92 2.07 -0.93 -3.38 116.25 122.15 1ce8 h VAL 231 Ca -0.27 -2.64 -0.02 0.00 0.82 0.00 0.00 66.70 64.59 1ce8 h VAL 231 Cb 1.12 2.59 -0.22 0.00 -1.52 0.00 0.00 31.29 33.26 1ce8 h VAL 231 CO 0.78 0.78 0.23 0.00 0.02 0.00 0.00 177.57 179.38 1ce8 s SER 233 N -0.09 5.01 -0.02 0.00 1.04 -1.26 -1.93 113.70 116.45 1ce8 s SER 233 Ca -0.02 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.12 1ce8 s SER 233 Cb -0.04 -1.16 0.02 0.00 0.10 0.00 0.00 66.02 64.95 1ce8 s SER 233 CO 0.02 0.10 0.00 -0.63 0.98 0.00 0.00 173.24 173.71 1ce8 s ILE 234 N -1.68 0.09 -0.16 -1.02 1.01 0.14 -3.85 121.20 115.74 1ce8 s ILE 234 Ca 0.28 0.08 -0.02 0.00 0.00 0.00 0.00 60.65 60.99 1ce8 s ILE 234 Cb -0.10 -0.17 -0.01 0.00 0.01 0.00 0.00 42.46 42.19 1ce8 s ILE 234 CO 0.20 0.09 -0.09 -0.70 0.00 0.00 0.00 174.94 174.44 1ce8 s GLU 235 N 0.70 3.42 0.19 2.79 2.12 -0.29 -1.84 118.70 125.80 1ce8 s GLU 235 Ca -0.06 -0.65 -0.30 0.00 0.36 0.00 0.00 54.97 54.32 1ce8 s GLU 235 Cb -0.09 -2.78 -0.08 0.00 0.26 0.00 0.00 34.13 31.44 1ce8 s GLU 235 CO -0.02 0.09 1.01 -0.80 -0.54 0.00 0.00 175.26 175.00 1ce8 s ASN 236 N 0.70 7.46 -0.01 -1.70 0.02 0.37 -1.33 114.94 120.44 1ce8 s ASN 236 Ca -0.05 1.98 -0.24 0.00 -1.02 0.00 0.00 52.86 53.54 1ce8 s ASN 236 Cb -0.15 -2.60 -0.20 0.00 0.02 0.00 0.00 41.25 38.32 1ce8 s ASN 236 CO 0.02 -0.04 1.20 0.15 0.02 0.00 0.00 177.10 178.44 1ce8 h PHE 237 N 4.77 0.24 -3.39 2.20 3.04 0.99 -3.43 116.94 121.37 1ce8 h PHE 237 Ca -0.44 -0.09 -0.54 0.00 3.98 0.00 0.00 57.97 60.87 1ce8 h PHE 237 Cb 1.21 -0.04 -0.02 0.00 2.56 0.00 0.00 35.95 39.65 1ce8 h PHE 237 CO 0.62 0.75 0.39 -0.51 -2.02 0.00 0.00 178.31 177.54 1ce8 s ASP 238 N -6.07 7.35 1.31 0.41 1.01 -1.20 -4.48 116.67 115.00 1ce8 s ASP 238 Ca -0.15 1.64 -0.20 0.00 0.71 0.00 0.00 52.55 54.54 1ce8 s ASP 238 Cb 0.02 -2.57 0.31 0.00 1.01 0.00 0.00 42.92 41.70 1ce8 s ASP 238 CO 0.73 -0.28 0.94 0.00 0.21 0.00 0.00 175.17 176.77 1ce8 n ALA 239 N 4.03 -3.78 -1.66 5.23 0.00 -1.26 -4.71 120.51 118.36 1ce8 n ALA 239 Ca 0.06 -1.48 -0.46 0.00 0.00 0.00 0.00 53.44 51.56 1ce8 n ALA 239 Cb 0.51 -0.11 -0.04 0.00 0.00 0.00 0.00 19.45 19.81 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 -4.94 2.00 0.00 0.00 2.81 -0.25 -2.90 117.12 113.85 1ce8 n MET 240 Ca 0.14 0.72 0.00 0.00 -1.81 0.00 0.00 57.70 56.75 1ce8 n MET 240 Cb 0.55 -2.43 0.00 0.00 -0.71 0.00 0.00 33.22 30.63 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 2.86 1.60 3.23 3.03 0.00 -1.26 -1.51 105.19 113.14 1ce8 n GLY 241 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.35 2.67 0.40 -0.61 1.01 -1.14 -3.30 121.20 118.87 1ce8 s ILE 242 Ca 0.00 -0.75 -0.24 0.00 0.00 0.00 0.00 60.65 59.66 1ce8 s ILE 242 Cb 0.00 -2.15 -0.11 0.00 0.01 0.00 0.00 42.46 40.20 1ce8 s ILE 242 CO 0.00 0.50 0.91 1.57 0.00 0.00 0.00 174.94 177.92 1ce8 n HIS 243 N 4.43 0.84 -0.24 3.97 -0.00 -0.91 -4.73 115.22 118.58 1ce8 n HIS 243 Ca -0.19 0.59 0.11 0.00 -0.00 0.00 0.00 57.72 58.23 1ce8 n HIS 243 Cb 0.51 -2.18 0.39 0.00 -0.00 0.00 0.00 29.99 28.71 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 1.43 0.86 0.00 3.57 1.35 -1.93 0.68 112.91 118.88 1ce8 h THR 244 Ca -0.43 -0.23 -0.01 0.00 -0.55 0.00 0.00 66.41 65.19 1ce8 h THR 244 Cb 1.35 0.13 -0.00 0.00 -1.73 0.00 0.00 68.15 67.90 1ce8 h THR 244 CO 0.56 0.12 -0.03 1.23 -0.25 0.00 0.00 175.52 177.15 1ce8 h GLY 245 N 0.68 0.00 -1.93 5.82 0.00 -1.97 -2.28 103.07 103.38 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 -3.14 3.14 -4.92 0.19 9.92 0.09 -4.73 116.55 117.09 1ce8 n ASP 246 Ca 0.01 -1.91 -0.28 0.00 -0.53 0.00 0.00 54.79 52.08 1ce8 n ASP 246 Cb 0.32 -0.20 -0.03 0.00 -0.64 0.00 0.00 41.12 40.57 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 -1.35 6.39 -0.01 -2.24 0.01 -0.36 -4.79 113.70 111.35 1ce8 s SER 247 Ca 0.32 0.45 -0.24 0.00 1.31 0.00 0.00 55.95 57.79 1ce8 s SER 247 Cb 0.19 -2.03 -0.05 0.00 0.21 0.00 0.00 66.02 64.35 1ce8 s SER 247 CO 0.27 -0.07 0.72 -0.63 0.41 0.00 0.00 173.24 173.94 1ce8 s ILE 248 N -1.90 4.91 0.11 1.44 1.01 -1.26 -4.26 121.20 121.24 1ce8 s ILE 248 Ca 0.39 1.51 0.04 0.00 0.00 0.00 0.00 60.65 62.60 1ce8 s ILE 248 Cb -0.11 -4.07 -0.04 0.00 0.01 0.00 0.00 42.46 38.26 1ce8 s ILE 248 CO 0.29 0.31 -0.11 0.42 0.00 0.00 0.00 174.94 175.85 1ce8 s THR 249 N 0.36 1.09 0.06 2.92 -4.23 -0.55 0.15 115.64 115.44 1ce8 s THR 249 Ca 0.38 -1.71 0.02 0.00 -1.18 0.00 0.00 61.69 59.20 1ce8 s THR 249 Cb -0.19 -1.47 -0.03 0.00 1.34 0.00 0.00 72.50 72.15 1ce8 s THR 249 CO 0.20 -0.54 -0.08 0.68 -0.54 0.00 0.00 174.62 174.35 1ce8 s VAL 250 N -2.45 0.64 -0.04 2.29 -7.23 -0.44 -0.25 120.40 112.92 1ce8 s VAL 250 Ca 0.08 -1.32 0.04 0.00 -1.81 0.00 0.00 61.98 58.97 1ce8 s VAL 250 Cb -0.03 -0.93 -0.00 0.00 0.56 0.00 0.00 36.38 35.98 1ce8 s VAL 250 CO 0.01 -0.49 -0.17 0.00 -0.31 0.00 0.00 175.10 174.14 1ce8 s ALA 251 N -1.94 1.50 0.33 1.32 0.00 -0.18 -1.14 121.76 121.66 1ce8 s ALA 251 Ca -0.04 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 51.26 1ce8 s ALA 251 Cb -0.06 -0.51 0.00 0.00 0.00 0.00 0.00 23.12 22.55 1ce8 s ALA 251 CO -0.01 0.26 0.00 -0.35 0.00 0.00 0.00 175.76 175.67 1ce8 n PRO 252 N 3.19 1.21 -1.75 0.00 -0.04 -1.26 -0.59 135.00 135.75 1ce8 n PRO 252 Ca -0.18 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 62.89 1ce8 n PRO 252 Cb 0.53 0.00 0.05 0.00 -0.04 0.00 0.00 33.50 34.04 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 -2.66 2.77 -0.08 0.55 0.00 -1.25 -4.42 121.76 116.67 1ce8 s ALA 253 Ca 0.00 1.35 -0.01 0.00 0.00 0.00 0.00 51.96 53.30 1ce8 s ALA 253 Cb 0.00 -3.58 -0.05 0.00 0.00 0.00 0.00 23.12 19.50 1ce8 s ALA 253 CO 0.00 -1.44 -0.08 1.04 0.00 0.00 0.00 175.76 175.29 1ce8 n GLN 254 N -1.14 0.19 -0.87 0.00 1.13 -1.26 -4.83 117.38 110.60 1ce8 n GLN 254 Ca 0.11 0.05 -0.05 0.00 -1.94 0.00 0.00 57.00 55.17 1ce8 n GLN 254 Cb 0.45 -1.06 0.25 0.00 0.11 0.00 0.00 30.24 29.99 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 -2.89 2.74 -4.29 5.09 -2.24 -1.26 -4.95 114.28 106.49 1ce8 n THR 255 Ca -0.14 -2.01 -0.35 0.00 -2.27 0.00 0.00 64.05 59.28 1ce8 n THR 255 Cb 0.64 -0.34 -0.09 0.00 -2.10 0.00 0.00 70.33 68.43 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 -3.07 3.64 0.69 3.22 1.43 -1.26 -5.09 118.68 118.24 1ce8 s LEU 256 Ca 0.50 0.13 -0.12 0.00 -1.03 0.00 0.00 54.13 53.61 1ce8 s LEU 256 Cb 0.42 -1.85 0.01 0.00 0.03 0.00 0.00 46.19 44.79 1ce8 s LEU 256 CO 0.09 0.33 1.07 0.42 0.23 0.00 0.00 176.35 178.49 1ce8 s THR 257 N -0.59 3.81 0.24 5.49 -4.23 -1.26 -4.80 115.64 114.30 1ce8 s THR 257 Ca 0.10 0.65 -0.04 0.00 -1.18 0.00 0.00 61.69 61.22 1ce8 s THR 257 Cb -0.12 -3.28 0.21 0.00 1.34 0.00 0.00 72.50 70.65 1ce8 s THR 257 CO 0.02 -0.71 1.79 -0.78 -0.54 0.00 0.00 174.62 174.40 1ce8 h ASP 258 N -0.54 0.57 -0.69 3.99 3.58 -1.98 -0.07 116.42 121.28 1ce8 h ASP 258 Ca -0.44 0.06 0.11 0.00 0.42 0.00 0.00 57.03 57.18 1ce8 h ASP 258 Cb 1.22 -0.04 -0.08 0.00 1.72 0.00 0.00 39.33 42.15 1ce8 h ASP 258 CO 0.56 0.30 0.28 0.11 -2.88 0.00 0.00 179.24 177.61 1ce8 h LYS 259 N 0.69 0.44 -0.04 0.28 1.57 -2.00 0.16 116.57 117.67 1ce8 h LYS 259 Ca 0.40 -0.03 -0.16 0.00 -1.87 0.00 0.00 60.65 58.99 1ce8 h LYS 259 Cb 0.44 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1ce8 h LYS 259 CO -0.28 0.29 -0.69 0.93 -0.57 0.00 0.00 179.45 179.13 1ce8 h GLU 260 N 0.45 0.19 -0.45 3.15 5.08 -1.64 -2.82 114.58 118.55 1ce8 h GLU 260 Ca 0.36 -0.16 -0.07 0.00 -1.00 0.00 0.00 59.36 58.50 1ce8 h GLU 260 Cb 0.48 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 1ce8 h GLU 260 CO -0.34 0.81 0.01 -0.92 -1.00 0.00 0.00 179.01 177.57 1ce8 h TYR 261 N 0.13 0.86 -0.64 4.33 3.20 -0.03 -1.83 116.97 122.99 1ce8 h TYR 261 Ca -0.02 -0.14 -0.09 0.00 3.14 0.00 0.00 58.73 61.62 1ce8 h TYR 261 Cb 1.23 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 39.25 1ce8 h TYR 261 CO 0.02 0.83 0.05 1.96 -1.64 0.00 0.00 178.16 179.38 1ce8 h GLN 262 N 0.64 1.10 -0.41 1.82 1.08 -0.65 0.10 115.11 118.78 1ce8 h GLN 262 Ca 0.13 -0.32 0.04 0.00 -1.45 0.00 0.00 58.65 57.05 1ce8 h GLN 262 Cb 0.48 -0.11 -0.04 0.00 -0.05 0.00 0.00 27.48 27.75 1ce8 h GLN 262 CO 0.02 1.04 0.18 0.82 -0.95 0.00 0.00 178.83 179.94 1ce8 h ILE 263 N 1.01 0.94 -0.36 2.54 2.04 -1.36 0.13 117.51 122.44 1ce8 h ILE 263 Ca 0.19 -0.13 -0.08 0.00 1.00 0.00 0.00 64.86 65.84 1ce8 h ILE 263 Cb 0.51 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 1ce8 h ILE 263 CO 0.02 0.07 -0.12 -0.03 0.00 0.00 0.00 178.15 178.09 1ce8 h MET 264 N 0.37 0.63 -0.12 2.37 4.05 -0.94 -0.70 114.93 120.60 1ce8 h MET 264 Ca 0.18 -0.20 -0.01 0.00 -0.28 0.00 0.00 59.70 59.39 1ce8 h MET 264 Cb 0.12 -0.06 -0.00 0.00 -0.80 0.00 0.00 31.60 30.86 1ce8 h MET 264 CO -0.15 0.74 0.04 -0.09 0.23 0.00 0.00 176.91 177.68 1ce8 h ARG 265 N 0.58 0.18 -0.46 0.39 2.43 -0.11 -1.40 114.38 115.98 1ce8 h ARG 265 Ca 0.10 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1ce8 h ARG 265 Cb 0.55 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.05 1ce8 h ARG 265 CO 0.03 0.31 0.24 -0.91 -1.51 0.00 0.00 179.97 178.14 1ce8 h ASN 266 N 0.01 0.59 -0.71 -3.80 -0.26 -0.59 -2.52 115.58 108.30 1ce8 h ASN 266 Ca 0.04 -0.10 0.04 0.00 -0.56 0.00 0.00 56.30 55.72 1ce8 h ASN 266 Cb 0.20 -0.15 -0.05 0.00 -1.06 0.00 0.00 38.32 37.27 1ce8 h ASN 266 CO -0.00 0.52 0.43 0.00 -1.06 0.00 0.00 177.43 177.32 1ce8 h ALA 267 N 1.09 0.94 -0.37 -0.83 0.00 -1.04 -0.18 119.26 118.87 1ce8 h ALA 267 Ca 0.16 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.09 1ce8 h ALA 267 Cb 0.07 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1ce8 h ALA 267 CO -0.02 0.18 0.17 0.77 0.00 0.00 0.00 179.25 180.35 1ce8 h SER 268 N 0.82 0.24 -0.55 0.00 0.02 -0.94 0.12 113.55 113.27 1ce8 h SER 268 Ca 0.30 0.02 -0.10 0.00 -0.84 0.00 0.00 61.79 61.17 1ce8 h SER 268 Cb 0.08 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 1ce8 h SER 268 CO -0.13 0.18 -0.03 0.24 -1.14 0.00 0.00 176.83 175.95 1ce8 h MET 269 N 0.36 1.01 -0.83 3.45 2.07 -1.09 -2.45 114.93 117.44 1ce8 h MET 269 Ca 0.16 -0.32 -0.00 0.00 -2.07 0.00 0.00 59.70 57.46 1ce8 h MET 269 Cb 0.09 -0.09 -0.04 0.00 -1.87 0.00 0.00 31.60 29.69 1ce8 h MET 269 CO -0.12 1.00 0.50 0.00 1.07 0.00 0.00 176.91 179.36 1ce8 h ALA 270 N 1.04 1.32 0.22 6.32 0.00 -0.40 -1.61 119.26 126.15 1ce8 h ALA 270 Ca 0.16 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1ce8 h ALA 270 Cb 0.57 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1ce8 h ALA 270 CO 0.03 0.59 -0.11 0.28 0.00 0.00 0.00 179.25 180.04 1ce8 h VAL 271 N 1.15 0.78 -0.71 0.00 2.07 -0.33 -0.61 116.25 118.59 1ce8 h VAL 271 Ca 0.30 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.79 1ce8 h VAL 271 Cb -0.05 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 1ce8 h VAL 271 CO -0.06 0.00 0.33 -0.07 0.02 0.00 0.00 177.57 177.79 1ce8 h LEU 272 N -0.30 0.92 -0.65 2.57 4.07 -1.22 -0.54 115.31 120.17 1ce8 h LEU 272 Ca -0.03 -0.11 -0.06 0.00 0.08 0.00 0.00 57.88 57.76 1ce8 h LEU 272 Cb 0.23 -0.24 -0.03 0.00 1.08 0.00 0.00 40.66 41.71 1ce8 h LEU 272 CO 0.05 0.79 0.16 0.03 -1.08 0.00 0.00 178.44 178.39 1ce8 h ARG 273 N 1.01 1.05 -0.02 1.13 3.08 -1.09 0.23 114.38 119.76 1ce8 h ARG 273 Ca 0.24 -0.25 -0.25 0.00 0.07 0.00 0.00 59.98 59.79 1ce8 h ARG 273 Cb 0.13 -0.14 0.01 0.00 0.08 0.00 0.00 29.97 30.05 1ce8 h ARG 273 CO -0.03 0.94 -0.98 1.49 -1.07 0.00 0.00 179.97 180.32 1ce8 h GLU 274 N 0.97 0.64 -0.21 0.04 4.57 -0.83 -3.08 114.58 116.67 1ce8 h GLU 274 Ca 0.20 -0.66 -0.10 0.00 -1.18 0.00 0.00 59.36 57.63 1ce8 h GLU 274 Cb 0.36 0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 29.12 1ce8 h GLU 274 CO 0.00 1.26 -0.29 0.82 -1.18 0.00 0.00 179.01 179.62 1ce8 h ILE 275 N 0.37 1.27 0.00 2.32 5.03 -1.03 -3.47 117.51 122.00 1ce8 h ILE 275 Ca -0.11 -1.32 0.00 0.00 -0.12 0.00 0.00 64.86 63.31 1ce8 h ILE 275 Cb 1.62 1.43 0.00 0.00 -3.03 0.00 0.00 36.82 36.84 1ce8 h ILE 275 CO 0.19 0.41 0.00 0.61 -0.68 0.00 0.00 178.15 178.68 1ce8 n GLY 276 N -0.33 1.87 3.56 5.37 0.00 0.62 -4.24 105.19 112.03 1ce8 n GLY 276 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1ce8 n GLY 276 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ce8 s VAL 277 N -2.00 4.69 -0.30 1.61 1.01 -0.12 -4.76 120.40 120.53 1ce8 s VAL 277 Ca 0.00 0.59 0.05 0.00 0.00 0.00 0.00 61.98 62.62 1ce8 s VAL 277 Cb 0.00 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.08 1ce8 s VAL 277 CO 0.00 -0.59 0.28 -0.62 0.00 0.00 0.00 175.10 174.17 1ce8 n GLU 278 N 6.57 4.52 -3.02 2.72 1.02 -1.26 -4.60 120.64 126.59 1ce8 n GLU 278 Ca 0.02 -0.13 -0.15 0.00 -0.02 0.00 0.00 57.16 56.88 1ce8 n GLU 278 Cb 0.48 -0.79 -0.01 0.00 -0.02 0.00 0.00 31.44 31.11 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 -0.90 0.15 -2.95 2.62 -2.24 -1.23 -2.03 114.28 107.70 1ce8 n THR 279 Ca 0.01 -3.97 0.00 0.00 -2.27 0.00 0.00 64.05 57.82 1ce8 n THR 279 Cb 0.09 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.41 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 0.18 -1.28 4.01 3.38 0.00 -0.77 -3.75 105.19 106.95 1ce8 n GLY 280 Ca 0.19 -0.90 -0.19 0.00 0.00 0.00 0.00 46.02 45.12 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 1.86 -0.18 -0.02 0.00 -1.26 -2.00 107.32 105.71 1ce8 s GLY 281 Ca 0.00 -1.76 -0.29 0.00 0.00 0.00 0.00 44.72 42.67 1ce8 s GLY 281 CO 0.00 -1.46 0.95 -0.56 0.00 0.00 0.00 173.10 172.02 1ce8 s SER 282 N -4.48 -0.45 -0.22 1.64 0.01 -0.33 -3.80 113.70 106.07 1ce8 s SER 282 Ca 0.58 0.63 -0.11 0.00 1.31 0.00 0.00 55.95 58.36 1ce8 s SER 282 Cb -0.09 0.56 -0.05 0.00 0.21 0.00 0.00 66.02 66.65 1ce8 s SER 282 CO 0.36 -0.32 0.19 0.21 0.41 0.00 0.00 173.24 174.09 1ce8 s ASN 283 N -0.67 6.20 -0.08 2.44 3.84 -0.87 -1.13 114.94 124.66 1ce8 s ASN 283 Ca -0.02 0.22 0.05 0.00 0.21 0.00 0.00 52.86 53.32 1ce8 s ASN 283 Cb -0.02 -2.12 -0.00 0.00 -0.55 0.00 0.00 41.25 38.56 1ce8 s ASN 283 CO 0.01 0.08 -0.24 -0.69 -2.79 0.00 0.00 177.10 173.47 1ce8 s VAL 284 N 0.85 2.07 0.03 -5.21 1.01 0.02 -1.06 120.40 118.11 1ce8 s VAL 284 Ca 0.10 -1.03 0.04 0.00 0.00 0.00 0.00 61.98 61.08 1ce8 s VAL 284 Cb -0.13 -1.77 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 1ce8 s VAL 284 CO 0.03 0.56 -0.08 -1.10 0.00 0.00 0.00 175.10 174.51 1ce8 s GLN 285 N 0.14 2.44 0.13 2.72 -0.21 0.19 -0.88 119.66 124.20 1ce8 s GLN 285 Ca -0.13 -0.80 -0.00 0.00 0.02 0.00 0.00 55.36 54.45 1ce8 s GLN 285 Cb -0.16 -2.44 -0.04 0.00 1.00 0.00 0.00 33.01 31.37 1ce8 s GLN 285 CO 0.07 0.58 0.04 -0.06 -2.12 0.00 0.00 175.29 173.80 1ce8 s PHE 286 N -1.03 0.91 -0.04 0.91 0.40 0.63 -0.63 117.98 119.13 1ce8 s PHE 286 Ca 0.18 -1.18 0.03 0.00 -0.60 0.00 0.00 56.93 55.36 1ce8 s PHE 286 Cb -0.11 -0.52 0.00 0.00 0.51 0.00 0.00 43.02 42.90 1ce8 s PHE 286 CO 0.09 -0.45 -0.13 0.00 0.70 0.00 0.00 175.22 175.42 1ce8 s ALA 287 N -3.96 1.25 -0.09 5.36 0.00 -0.20 -1.53 121.76 122.59 1ce8 s ALA 287 Ca 0.23 -0.51 0.03 0.00 0.00 0.00 0.00 51.96 51.70 1ce8 s ALA 287 Cb 0.07 -0.45 0.01 0.00 0.00 0.00 0.00 23.12 22.75 1ce8 s ALA 287 CO 0.01 0.20 -0.17 0.08 0.00 0.00 0.00 175.76 175.89 1ce8 s VAL 288 N 0.22 1.53 -0.45 0.00 1.01 0.08 -0.64 120.40 122.15 1ce8 s VAL 288 Ca -0.06 -0.69 -0.29 0.00 0.00 0.00 0.00 61.98 60.94 1ce8 s VAL 288 Cb -0.11 -1.37 0.03 0.00 0.00 0.00 0.00 36.38 34.93 1ce8 s VAL 288 CO 0.02 0.44 1.13 0.21 0.00 0.00 0.00 175.10 176.91 1ce8 s ASN 289 N 0.67 6.68 0.66 3.32 3.84 -0.02 -0.59 114.94 129.51 1ce8 s ASN 289 Ca -0.13 0.58 0.39 0.00 0.21 0.00 0.00 52.86 53.90 1ce8 s ASN 289 Cb -0.16 -2.55 2.11 0.00 -0.55 0.00 0.00 41.25 40.10 1ce8 s ASN 289 CO 0.04 -1.19 2.20 1.55 -2.79 0.00 0.00 177.10 176.90 1ce8 h PRO 290 N 9.05 0.00 0.00 0.43 0.13 -1.93 0.92 132.00 140.60 1ce8 h PRO 290 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 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 1.11 0.00 -0.21 0.87 -0.23 0.00 0.00 178.00 179.54 1ce8 h LYS 291 N 0.00 0.00 0.00 0.86 1.57 -1.98 -3.38 116.57 113.63 1ce8 h LYS 291 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ce8 h LYS 291 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1ce8 h LYS 291 CO -0.00 0.00 0.00 0.27 -0.57 0.00 0.00 179.45 179.15 1ce8 n ASN 292 N -2.53 0.00 -0.25 0.86 0.23 -0.78 -5.01 115.26 107.78 1ce8 n ASN 292 Ca 0.04 -1.00 -0.03 0.00 -0.53 0.00 0.00 54.58 53.06 1ce8 n ASN 292 Cb 0.47 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 38.16 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 0.39 3.68 4.83 0.00 0.31 -4.93 105.19 109.47 1ce8 n GLY 293 Ca 0.00 -0.03 -0.55 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.18 1.33 -3.52 1.61 0.63 -1.20 -4.54 116.66 110.79 1ce8 n ARG 294 Ca -0.03 0.49 -0.37 0.00 -0.92 0.00 0.00 57.85 57.02 1ce8 n ARG 294 Cb 0.45 -2.19 -0.07 0.00 0.45 0.00 0.00 32.46 31.10 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 2.83 4.27 -0.06 6.15 2.96 -1.26 -0.84 118.68 132.73 1ce8 s LEU 295 Ca 0.94 0.58 0.01 0.00 -0.22 0.00 0.00 54.13 55.44 1ce8 s LEU 295 Cb -0.98 -2.42 0.02 0.00 0.50 0.00 0.00 46.19 43.31 1ce8 s LEU 295 CO 0.59 0.12 -0.07 -0.63 -1.32 0.00 0.00 176.35 175.03 1ce8 s ILE 296 N 0.31 0.77 0.02 6.68 1.01 0.19 -4.50 121.20 125.68 1ce8 s ILE 296 Ca 0.18 -0.25 -0.26 0.00 0.00 0.00 0.00 60.65 60.32 1ce8 s ILE 296 Cb -0.13 -0.76 -0.05 0.00 0.01 0.00 0.00 42.46 41.53 1ce8 s ILE 296 CO 0.05 0.28 0.82 -0.69 0.00 0.00 0.00 174.94 175.40 1ce8 s VAL 297 N 0.92 4.79 -0.22 2.92 1.01 0.16 -1.03 120.40 128.95 1ce8 s VAL 297 Ca -0.11 1.73 -0.16 0.00 0.00 0.00 0.00 61.98 63.44 1ce8 s VAL 297 Cb -0.15 -4.16 -0.12 0.00 0.00 0.00 0.00 36.38 31.95 1ce8 s VAL 297 CO 0.01 0.30 -0.15 -0.38 0.00 0.00 0.00 175.10 174.87 1ce8 n ILE 298 N 3.19 1.51 -3.82 2.22 2.08 0.20 -4.59 119.36 120.16 1ce8 n ILE 298 Ca -0.00 -0.09 -0.01 0.00 0.56 0.00 0.00 62.75 63.21 1ce8 n ILE 298 Cb 0.50 -2.09 0.01 0.00 -0.75 0.00 0.00 39.64 37.31 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 -2.49 0.86 -0.11 0.38 -1.05 -1.24 -5.01 118.70 110.04 1ce8 s GLU 299 Ca -0.30 -0.53 -0.13 0.00 -0.15 0.00 0.00 54.97 53.86 1ce8 s GLU 299 Cb 0.08 0.26 0.03 0.00 -0.44 0.00 0.00 34.13 34.07 1ce8 s GLU 299 CO 0.47 -0.40 0.35 0.00 0.95 0.00 0.00 175.26 176.62 1ce8 s MET 300 N -2.41 0.47 -0.31 -4.83 0.23 -1.26 -0.64 119.30 110.55 1ce8 s MET 300 Ca 0.20 0.37 0.01 0.00 -1.03 0.00 0.00 55.69 55.24 1ce8 s MET 300 Cb -0.00 0.22 0.07 0.00 -1.53 0.00 0.00 34.83 33.59 1ce8 s MET 300 CO 0.01 -0.08 -0.00 -0.80 -2.03 0.00 0.00 175.02 172.12 1ce8 s ASN 301 N -0.10 4.75 0.00 -1.18 0.01 -0.22 -4.75 114.94 113.45 1ce8 s ASN 301 Ca -0.03 -1.61 -0.02 0.00 -0.71 0.00 0.00 52.86 50.49 1ce8 s ASN 301 Cb -0.03 -1.65 -0.09 0.00 0.41 0.00 0.00 41.25 39.89 1ce8 s ASN 301 CO 0.01 -0.30 1.61 -0.81 -1.51 0.00 0.00 177.10 176.11 1ce8 n PRO 302 N 4.46 0.75 -3.83 -0.60 -0.04 -1.26 -2.06 135.00 132.43 1ce8 n PRO 302 Ca -0.08 -0.34 -0.01 0.00 -0.04 0.00 0.00 63.50 63.04 1ce8 n PRO 302 Cb 0.42 -1.63 0.02 0.00 -0.04 0.00 0.00 33.50 32.27 1ce8 n PRO 302 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1ce8 n ARG 303 N 2.60 0.43 -1.98 0.54 1.85 -1.25 -4.86 116.66 114.00 1ce8 n ARG 303 Ca 0.14 -1.14 -0.33 0.00 -1.00 0.00 0.00 57.85 55.53 1ce8 n ARG 303 Cb 0.35 1.63 0.02 0.00 -1.05 0.00 0.00 32.46 33.41 1ce8 n ARG 303 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 1ce8 s VAL 304 N -2.06 3.75 0.00 8.89 -7.23 -1.00 -4.24 120.40 118.52 1ce8 s VAL 304 Ca 0.25 0.81 0.00 0.00 -1.81 0.00 0.00 61.98 61.23 1ce8 s VAL 304 Cb -0.02 -3.35 0.00 0.00 0.56 0.00 0.00 36.38 33.57 1ce8 s VAL 304 CO 0.03 -0.51 0.00 -1.54 -0.31 0.00 0.00 175.10 172.77 1ce8 n SER 305 N -2.14 0.00 0.11 4.85 3.41 -1.26 -4.70 113.62 113.88 1ce8 n SER 305 Ca 0.09 -0.85 -0.04 0.00 -0.26 0.00 0.00 58.87 57.81 1ce8 n SER 305 Cb 0.53 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.60 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 0.10 -0.07 4.33 0.11 -1.94 -2.18 114.38 114.73 1ce8 h ARG 306 Ca 0.00 -0.07 -0.21 0.00 0.10 0.00 0.00 59.98 59.79 1ce8 h ARG 306 Cb 0.00 0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.10 1ce8 h ARG 306 CO 0.00 0.72 -0.83 0.77 0.10 0.00 0.00 179.97 180.73 1ce8 h SER 307 N 0.07 0.64 0.11 0.08 0.02 -1.98 -1.55 113.55 110.93 1ce8 h SER 307 Ca -0.01 -0.45 -0.13 0.00 -0.84 0.00 0.00 61.79 60.35 1ce8 h SER 307 Cb 1.18 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.52 1ce8 h SER 307 CO 0.09 1.23 -0.47 0.77 -1.14 0.00 0.00 176.83 177.31 1ce8 h SER 308 N 0.33 0.46 -0.24 3.07 4.64 -1.93 0.60 113.55 120.49 1ce8 h SER 308 Ca -0.06 -0.22 -0.04 0.00 -0.47 0.00 0.00 61.79 61.01 1ce8 h SER 308 Cb 1.44 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 63.39 1ce8 h SER 308 CO 0.15 0.86 0.01 0.00 -0.87 0.00 0.00 176.83 176.98 1ce8 h ALA 309 N 1.16 0.33 -0.05 5.18 0.00 -1.36 0.22 119.26 124.72 1ce8 h ALA 309 Ca 0.02 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1ce8 h ALA 309 Cb 0.95 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 1ce8 h ALA 309 CO 0.08 0.05 0.03 1.25 0.00 0.00 0.00 179.25 180.66 1ce8 h LEU 310 N 0.20 0.04 -0.72 0.00 5.85 -0.70 -1.48 115.31 118.51 1ce8 h LEU 310 Ca 0.07 0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.88 1ce8 h LEU 310 Cb 0.40 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.35 1ce8 h LEU 310 CO 0.01 0.03 0.37 0.00 -0.34 0.00 0.00 178.44 178.51 1ce8 h ALA 311 N 1.03 1.00 -0.24 1.25 0.00 0.31 0.53 119.26 123.14 1ce8 h ALA 311 Ca 0.02 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ce8 h ALA 311 Cb 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1ce8 h ALA 311 CO -0.01 -0.03 0.16 0.77 0.00 0.00 0.00 179.25 180.13 1ce8 h SER 312 N 0.62 0.28 -0.56 0.00 0.02 -0.22 -0.11 113.55 113.58 1ce8 h SER 312 Ca 0.36 -0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 61.20 1ce8 h SER 312 Cb 0.37 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 1ce8 h SER 312 CO -0.27 0.20 -0.01 0.11 -1.14 0.00 0.00 176.83 175.72 1ce8 h LYS 313 N 0.33 1.01 -0.55 3.45 6.56 -0.41 0.30 116.57 127.26 1ce8 h LYS 313 Ca 0.09 -0.32 -0.10 0.00 -1.06 0.00 0.00 60.65 59.27 1ce8 h LYS 313 Cb -0.04 -0.10 -0.02 0.00 -0.57 0.00 0.00 32.23 31.51 1ce8 h LYS 313 CO -0.02 1.00 -0.04 0.00 -2.06 0.00 0.00 179.45 178.33 1ce8 h ALA 314 N 1.05 0.90 0.00 3.86 0.00 0.59 -3.33 119.26 122.32 1ce8 h ALA 314 Ca 0.17 -0.31 -0.36 0.00 0.00 0.00 0.00 54.91 54.40 1ce8 h ALA 314 Cb 0.55 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.07 1ce8 h ALA 314 CO 0.03 0.65 -2.29 0.25 0.00 0.00 0.00 179.25 177.88 1ce8 n THR 315 N -4.17 1.43 -0.29 0.00 -2.24 -0.10 -4.99 114.28 103.93 1ce8 n THR 315 Ca 0.02 -0.83 0.00 0.00 -2.27 0.00 0.00 64.05 60.97 1ce8 n THR 315 Cb 0.35 -0.63 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 1ce8 n THR 315 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ce8 n GLY 316 N 1.76 0.81 3.43 3.38 0.00 0.09 -2.56 105.19 112.10 1ce8 n GLY 316 Ca -0.31 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.27 1ce8 n GLY 316 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ce8 s PHE 317 N -2.13 3.17 -1.23 1.61 2.19 -1.21 -4.66 117.98 115.72 1ce8 s PHE 317 Ca 0.00 -0.67 -0.21 0.00 0.33 0.00 0.00 56.93 56.39 1ce8 s PHE 317 Cb 0.00 -3.18 -0.02 0.00 -1.31 0.00 0.00 43.02 38.51 1ce8 s PHE 317 CO 0.00 -0.83 1.84 -1.25 1.83 0.00 0.00 175.22 176.81 1ce8 s PRO 318 N 2.05 3.14 0.21 10.12 0.04 -1.26 -4.17 135.00 145.13 1ce8 s PRO 318 Ca 0.09 -1.51 -0.13 0.00 0.04 0.00 0.00 61.00 59.49 1ce8 s PRO 318 Cb -0.21 -5.37 0.25 0.00 0.04 0.00 0.00 34.50 29.21 1ce8 s PRO 318 CO 0.10 -3.22 1.63 0.82 0.04 0.00 0.00 177.00 176.36 1ce8 h ILE 319 N 5.94 0.36 -0.71 0.56 2.04 -1.93 -1.63 117.51 122.15 1ce8 h ILE 319 Ca 0.31 -0.00 -0.06 0.00 1.00 0.00 0.00 64.86 66.11 1ce8 h ILE 319 Cb 0.91 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 1ce8 h ILE 319 CO 1.33 0.00 0.19 0.00 0.00 0.00 0.00 178.15 179.67 1ce8 h ALA 320 N 1.64 1.00 -0.56 1.87 0.00 -1.91 0.57 119.26 121.87 1ce8 h ALA 320 Ca 0.31 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1ce8 h ALA 320 Cb 0.48 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1ce8 h ALA 320 CO -0.66 0.66 0.27 -0.22 0.00 0.00 0.00 179.25 179.30 1ce8 h LYS 321 N 1.07 0.81 -0.29 0.00 3.64 -1.69 0.22 116.57 120.32 1ce8 h LYS 321 Ca 0.23 -0.12 -0.12 0.00 -1.27 0.00 0.00 60.65 59.36 1ce8 h LYS 321 Cb 0.34 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1ce8 h LYS 321 CO -0.00 0.66 -0.30 0.28 -2.27 0.00 0.00 179.45 177.82 1ce8 h VAL 322 N 0.76 1.30 -0.60 2.00 2.07 -0.87 -2.84 116.25 118.06 1ce8 h VAL 322 Ca 0.19 -1.47 -0.01 0.00 0.82 0.00 0.00 66.70 66.24 1ce8 h VAL 322 Cb 0.12 1.57 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 1ce8 h VAL 322 CO -0.02 0.47 0.34 0.00 0.02 0.00 0.00 177.57 178.37 1ce8 h ALA 323 N 0.71 0.77 -0.25 1.67 0.00 0.43 -0.84 119.26 121.75 1ce8 h ALA 323 Ca 0.05 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1ce8 h ALA 323 Cb 0.87 -0.24 -0.07 0.00 0.00 0.00 0.00 17.79 18.35 1ce8 h ALA 323 CO 0.07 0.28 -0.24 0.00 0.00 0.00 0.00 179.25 179.36 1ce8 h ALA 324 N 1.16 -0.13 0.00 0.00 0.00 -0.49 0.25 119.26 120.05 1ce8 h ALA 324 Ca 0.21 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 1ce8 h ALA 324 Cb 0.03 0.51 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1ce8 h ALA 324 CO -0.04 -0.67 -0.11 0.87 0.00 0.00 0.00 179.25 179.31 1ce8 h LYS 325 N -0.25 0.00 0.00 0.00 1.57 -1.25 -1.36 116.57 115.28 1ce8 h LYS 325 Ca 0.14 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.82 1ce8 h LYS 325 Cb 0.46 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 1ce8 h LYS 325 CO -0.39 0.11 -0.49 -0.07 -0.57 0.00 0.00 179.45 178.04 1ce8 h LEU 326 N 0.00 0.00 -2.05 2.94 4.07 0.47 -2.44 115.31 118.29 1ce8 h LEU 326 Ca -0.00 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.95 1ce8 h LEU 326 Cb 0.20 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.94 1ce8 h LEU 326 CO 0.01 0.49 -0.04 0.00 -1.08 0.00 0.00 178.44 177.82 1ce8 h ALA 327 N 1.51 1.07 -0.68 1.53 0.00 -0.02 -2.94 119.26 119.73 1ce8 h ALA 327 Ca -0.00 -0.03 -0.42 0.00 0.00 0.00 0.00 54.91 54.45 1ce8 h ALA 327 Cb 0.94 -0.01 -0.24 0.00 0.00 0.00 0.00 17.79 18.48 1ce8 h ALA 327 CO 0.06 0.04 0.13 1.33 0.00 0.00 0.00 179.25 180.82 1ce8 n VAL 328 N -3.23 2.91 0.00 0.00 0.24 -0.97 -4.46 118.33 112.82 1ce8 n VAL 328 Ca -0.01 -2.92 0.00 0.00 -2.04 0.00 0.00 64.34 59.37 1ce8 n VAL 328 Cb 0.22 -0.68 0.00 0.00 -1.47 0.00 0.00 33.84 31.91 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 -1.01 3.04 3.75 7.63 0.00 -1.11 -0.28 105.19 117.21 1ce8 n GLY 329 Ca 0.47 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.15 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 -2.21 2.39 0.22 1.61 2.02 -0.96 -4.29 117.35 116.12 1ce8 s TYR 330 Ca 0.00 1.58 0.08 0.00 -0.37 0.00 0.00 57.07 58.35 1ce8 s TYR 330 Cb 0.00 -3.28 -0.04 0.00 -0.40 0.00 0.00 41.96 38.24 1ce8 s TYR 330 CO 0.00 -2.04 0.03 0.95 -1.57 0.00 0.00 175.55 172.92 1ce8 s THR 331 N -2.22 3.75 0.29 -0.71 -4.23 -1.24 -4.44 115.64 106.86 1ce8 s THR 331 Ca 0.70 -1.58 -0.00 0.00 -1.18 0.00 0.00 61.69 59.63 1ce8 s THR 331 Cb -0.24 -2.95 0.28 0.00 1.34 0.00 0.00 72.50 70.93 1ce8 s THR 331 CO 0.43 -0.23 1.90 -0.07 -0.54 0.00 0.00 174.62 176.11 1ce8 h LEU 332 N 2.25 0.94 -2.50 4.79 3.38 -1.94 -1.97 115.31 120.25 1ce8 h LEU 332 Ca -0.46 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.51 1ce8 h LEU 332 Cb 1.22 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 1ce8 h LEU 332 CO 0.59 0.60 -0.02 -2.24 0.09 0.00 0.00 178.44 177.47 1ce8 h ASP 333 N 1.06 0.00 1.10 -0.43 2.03 -1.92 -2.27 116.42 116.00 1ce8 h ASP 333 Ca 0.40 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.70 1ce8 h ASP 333 Cb 0.20 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.70 1ce8 h ASP 333 CO -0.15 0.02 -0.77 -0.33 -1.03 0.00 0.00 179.24 176.97 1ce8 h GLU 334 N 0.00 0.00 -6.61 4.15 5.08 -1.77 -3.45 114.58 111.98 1ce8 h GLU 334 Ca -0.00 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.85 1ce8 h GLU 334 Cb 0.05 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 1ce8 h GLU 334 CO 0.00 0.00 -0.00 -0.51 -1.00 0.00 0.00 179.01 177.50 1ce8 s LEU 335 N -5.20 4.08 0.17 1.33 1.43 -0.88 -4.99 118.68 114.63 1ce8 s LEU 335 Ca 0.02 1.09 0.04 0.00 -1.03 0.00 0.00 54.13 54.25 1ce8 s LEU 335 Cb 0.10 -3.89 -0.04 0.00 0.03 0.00 0.00 46.19 42.40 1ce8 s LEU 335 CO 0.76 -0.17 0.26 -0.04 0.23 0.00 0.00 176.35 177.38 1ce8 s MET 336 N -3.03 3.28 -0.29 1.70 -1.94 -1.26 -0.43 119.30 117.33 1ce8 s MET 336 Ca 0.51 -0.71 -0.24 0.00 -1.71 0.00 0.00 55.69 53.53 1ce8 s MET 336 Cb -0.11 -2.85 0.00 0.00 2.01 0.00 0.00 34.83 33.88 1ce8 s MET 336 CO 0.21 0.49 0.81 1.21 -0.01 0.00 0.00 175.02 177.73 1ce8 s ASN 337 N -3.35 6.71 0.11 3.03 2.47 0.33 -4.37 114.94 119.87 1ce8 s ASN 337 Ca 0.33 0.77 -0.31 0.00 0.42 0.00 0.00 52.86 54.08 1ce8 s ASN 337 Cb -0.10 -2.42 -0.11 0.00 -1.45 0.00 0.00 41.25 37.17 1ce8 s ASN 337 CO 0.27 -0.61 1.60 0.44 -3.72 0.00 0.00 177.10 175.08 1ce8 h ASP 338 N 8.02 -1.10 0.33 -4.21 3.32 -1.91 0.91 116.42 121.77 1ce8 h ASP 338 Ca -0.24 0.11 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 1ce8 h ASP 338 Cb 1.09 0.40 -0.00 0.00 0.22 0.00 0.00 39.33 41.04 1ce8 h ASP 338 CO 0.89 -0.49 -0.03 0.16 -1.72 0.00 0.00 179.24 178.05 1ce8 h ILE 339 N -0.68 0.19 -0.80 0.35 3.07 -1.89 -2.45 117.51 115.30 1ce8 h ILE 339 Ca 0.01 -0.25 -0.48 0.00 1.55 0.00 0.00 64.86 65.68 1ce8 h ILE 339 Cb 0.67 1.21 -0.24 0.00 -0.27 0.00 0.00 36.82 38.18 1ce8 h ILE 339 CO -0.17 0.03 0.62 0.35 -1.05 0.00 0.00 178.15 177.93 1ce8 n THR 340 N -3.30 3.05 -1.30 0.16 -2.24 -1.21 -3.87 114.28 105.58 1ce8 n THR 340 Ca -0.02 -2.01 -0.10 0.00 -2.27 0.00 0.00 64.05 59.65 1ce8 n THR 340 Cb 0.17 -0.91 -0.04 0.00 -2.10 0.00 0.00 70.33 67.44 1ce8 n THR 340 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ce8 n GLY 341 N -0.63 0.98 2.23 3.38 0.00 -0.93 -0.71 105.19 109.53 1ce8 n GLY 341 Ca 0.49 -0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.46 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 0.31 0.79 0.00 -0.02 0.00 0.31 -4.87 105.19 101.71 1ce8 n GLY 342 Ca -0.10 -0.57 0.13 0.00 0.00 0.00 0.00 46.02 45.48 1ce8 n GLY 342 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ce8 n ARG 343 N -2.55 0.01 -4.29 1.61 1.74 0.12 -4.66 116.66 108.64 1ce8 n ARG 343 Ca -0.05 0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 56.83 1ce8 n ARG 343 Cb 0.21 -1.51 -0.11 0.00 -1.02 0.00 0.00 32.46 30.03 1ce8 n ARG 343 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1ce8 s THR 344 N -3.00 1.62 0.94 0.55 -4.23 -1.26 -5.03 115.64 105.23 1ce8 s THR 344 Ca 0.13 -1.82 -0.12 0.00 -1.18 0.00 0.00 61.69 58.69 1ce8 s THR 344 Cb 0.18 -1.71 0.15 0.00 1.34 0.00 0.00 72.50 72.46 1ce8 s THR 344 CO 0.60 -0.35 1.11 -2.16 -0.54 0.00 0.00 174.62 173.29 1ce8 s PRO 345 N -2.72 0.95 0.20 3.99 0.04 -1.26 0.12 135.00 136.32 1ce8 s PRO 345 Ca 0.13 0.43 0.24 0.00 0.04 0.00 0.00 61.00 61.84 1ce8 s PRO 345 Cb -0.06 -1.80 0.46 0.00 0.04 0.00 0.00 34.50 33.14 1ce8 s PRO 345 CO 0.05 -2.36 1.48 0.00 0.04 0.00 0.00 177.00 176.21 1ce8 h ALA 346 N -1.62 0.77 -0.75 8.56 0.00 -0.67 -3.33 119.26 122.22 1ce8 h ALA 346 Ca -0.52 0.00 -0.68 0.00 0.00 0.00 0.00 54.91 53.71 1ce8 h ALA 346 Cb 1.32 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 19.04 1ce8 h ALA 346 CO 0.60 0.00 2.33 -1.13 0.00 0.00 0.00 179.25 181.05 1ce8 n SER 347 N -2.36 4.80 -3.68 0.00 3.41 -1.08 -4.86 113.62 109.86 1ce8 n SER 347 Ca 0.04 -2.91 -0.05 0.00 -0.26 0.00 0.00 58.87 55.69 1ce8 n SER 347 Cb 0.46 -1.74 -0.02 0.00 -0.26 0.00 0.00 64.21 62.66 1ce8 n SER 347 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1ce8 s PHE 348 N 4.05 -0.20 -0.20 7.33 -0.71 -1.26 -4.94 117.98 122.04 1ce8 s PHE 348 Ca 0.53 -0.06 -0.05 0.00 -1.04 0.00 0.00 56.93 56.31 1ce8 s PHE 348 Cb 0.05 0.61 -0.02 0.00 -1.21 0.00 0.00 43.02 42.45 1ce8 s PHE 348 CO 0.06 -0.76 -0.00 -1.21 -1.34 0.00 0.00 175.22 171.97 1ce8 s GLU 349 N -3.26 3.60 0.63 1.99 2.02 -1.26 -4.81 118.70 117.59 1ce8 s GLU 349 Ca 0.10 -0.53 -0.19 0.00 0.02 0.00 0.00 54.97 54.37 1ce8 s GLU 349 Cb -0.01 -3.08 -0.02 0.00 0.10 0.00 0.00 34.13 31.11 1ce8 s GLU 349 CO -0.01 -0.02 1.31 -2.14 0.02 0.00 0.00 175.26 174.42 1ce8 s PRO 350 N 1.07 2.68 -0.06 0.39 0.02 -1.26 -5.00 135.00 132.84 1ce8 s PRO 350 Ca 0.02 2.10 0.01 0.00 0.02 0.00 0.00 61.00 63.15 1ce8 s PRO 350 Cb -0.14 -1.93 0.02 0.00 0.02 0.00 0.00 34.50 32.46 1ce8 s PRO 350 CO 0.01 -1.51 -0.07 0.45 -0.33 0.00 0.00 177.00 175.56 1ce8 s SER 351 N -1.30 1.38 0.07 2.53 0.15 0.38 -4.96 113.70 111.95 1ce8 s SER 351 Ca 0.80 -0.20 0.08 0.00 0.70 0.00 0.00 55.95 57.33 1ce8 s SER 351 Cb -0.38 -0.61 -0.04 0.00 -1.71 0.00 0.00 66.02 63.29 1ce8 s SER 351 CO 0.41 -0.04 -0.18 0.27 1.20 0.00 0.00 173.24 174.90 1ce8 s ILE 352 N 1.00 2.83 -0.59 6.45 -4.36 -1.26 -0.32 121.20 124.95 1ce8 s ILE 352 Ca -0.09 -1.30 0.02 0.00 -0.26 0.00 0.00 60.65 59.01 1ce8 s ILE 352 Cb -0.14 -2.23 0.41 0.00 1.25 0.00 0.00 42.46 41.74 1ce8 s ILE 352 CO -0.00 0.24 1.61 -0.90 0.24 0.00 0.00 174.94 176.13 1ce8 n ASP 353 N 1.25 6.28 -2.92 4.36 5.75 -1.26 -4.84 116.55 125.17 1ce8 n ASP 353 Ca -0.16 -3.78 -0.02 0.00 -0.01 0.00 0.00 54.79 50.82 1ce8 n ASP 353 Cb 0.52 -0.74 0.02 0.00 -1.03 0.00 0.00 41.12 39.89 1ce8 n ASP 353 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ce8 n TYR 354 N -0.63 -1.17 -4.96 2.11 0.18 -1.26 -4.86 117.16 106.56 1ce8 n TYR 354 Ca 0.50 -1.02 -0.32 0.00 1.88 0.00 0.00 57.90 58.93 1ce8 n TYR 354 Cb 0.58 0.50 -0.15 0.00 -0.38 0.00 0.00 39.34 39.89 1ce8 n TYR 354 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 1ce8 s VAL 355 N -2.14 2.68 -0.15 -3.48 1.01 0.46 -4.67 120.40 114.11 1ce8 s VAL 355 Ca 0.19 -0.81 -0.05 0.00 0.00 0.00 0.00 61.98 61.32 1ce8 s VAL 355 Cb -0.02 -2.08 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 1ce8 s VAL 355 CO 0.04 0.55 0.01 -0.69 0.00 0.00 0.00 175.10 175.01 1ce8 s VAL 356 N 0.14 4.29 -0.06 2.92 1.01 0.24 -2.33 120.40 126.61 1ce8 s VAL 356 Ca -0.09 -0.22 0.04 0.00 0.00 0.00 0.00 61.98 61.71 1ce8 s VAL 356 Cb -0.15 -2.88 -0.00 0.00 0.00 0.00 0.00 36.38 33.34 1ce8 s VAL 356 CO 0.06 0.51 -0.20 -0.89 0.00 0.00 0.00 175.10 174.57 1ce8 s THR 357 N 0.09 1.72 -0.08 3.92 2.01 -0.17 -1.01 115.64 122.13 1ce8 s THR 357 Ca 0.02 -0.86 0.05 0.00 0.31 0.00 0.00 61.69 61.21 1ce8 s THR 357 Cb -0.13 -1.48 -0.01 0.00 0.01 0.00 0.00 72.50 70.89 1ce8 s THR 357 CO 0.02 0.49 -0.24 -0.75 -0.69 0.00 0.00 174.62 173.44 1ce8 s LYS 358 N 0.14 2.76 -0.08 4.92 2.20 0.66 -0.83 119.74 129.50 1ce8 s LYS 358 Ca -0.09 -0.89 0.03 0.00 -0.36 0.00 0.00 55.97 54.65 1ce8 s LYS 358 Cb -0.14 -2.22 0.01 0.00 -1.51 0.00 0.00 37.83 33.96 1ce8 s LYS 358 CO 0.04 0.30 -0.16 0.42 -0.36 0.00 0.00 175.35 175.59 1ce8 s ILE 359 N 0.04 1.47 0.64 5.43 1.01 -0.20 -1.49 121.20 128.11 1ce8 s ILE 359 Ca -0.10 -0.66 -0.15 0.00 0.00 0.00 0.00 60.65 59.74 1ce8 s ILE 359 Cb -0.15 -1.31 -0.01 0.00 0.01 0.00 0.00 42.46 40.99 1ce8 s ILE 359 CO 0.06 0.43 1.08 -2.16 0.00 0.00 0.00 174.94 174.35 1ce8 s PRO 360 N 0.64 2.98 -0.17 2.79 0.04 -1.26 -1.78 135.00 138.24 1ce8 s PRO 360 Ca -0.14 1.27 -0.02 0.00 0.04 0.00 0.00 61.00 62.16 1ce8 s PRO 360 Cb -0.16 -1.98 -0.01 0.00 0.04 0.00 0.00 34.50 32.39 1ce8 s PRO 360 CO 0.04 -1.09 -0.10 0.50 0.04 0.00 0.00 177.00 176.39 1ce8 s ARG 361 N -4.20 3.34 0.49 4.56 6.06 -0.31 -4.86 118.95 124.02 1ce8 s ARG 361 Ca 0.65 -0.67 0.05 0.00 -2.50 0.00 0.00 55.73 53.25 1ce8 s ARG 361 Cb -0.18 -2.79 -0.01 0.00 0.06 0.00 0.00 34.95 32.04 1ce8 s ARG 361 CO 0.42 -0.00 0.23 -0.06 -2.50 0.00 0.00 175.30 173.38 1ce8 s PHE 362 N 0.92 2.04 -0.32 5.12 0.40 -1.26 -0.65 117.98 124.23 1ce8 s PHE 362 Ca -0.02 -0.78 0.16 0.00 -0.60 0.00 0.00 56.93 55.70 1ce8 s PHE 362 Cb -0.15 -1.86 0.45 0.00 0.51 0.00 0.00 43.02 41.97 1ce8 s PHE 362 CO -0.00 -0.07 1.32 0.09 0.70 0.00 0.00 175.22 177.25 1ce8 n ASN 363 N -1.46 -0.20 -0.06 1.36 5.03 -1.26 -4.87 115.26 113.80 1ce8 n ASN 363 Ca -0.06 -2.22 0.20 0.00 0.87 0.00 0.00 54.58 53.37 1ce8 n ASN 363 Cb 0.65 0.21 0.66 0.00 -1.02 0.00 0.00 39.78 40.28 1ce8 n ASN 363 CO 0.00 0.00 0.00 -0.26 -1.83 0.00 0.00 177.26 175.17 1ce8 h PHE 364 N 1.86 0.10 0.00 3.10 0.04 -1.93 0.13 116.94 120.24 1ce8 h PHE 364 Ca -0.29 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.48 1ce8 h PHE 364 Cb 1.28 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 39.40 1ce8 h PHE 364 CO 0.20 0.04 0.00 -0.85 -0.60 0.00 0.00 178.31 177.10 1ce8 n GLU 365 N -4.39 0.12 0.00 1.51 0.00 -1.26 -0.37 120.64 116.25 1ce8 n GLU 365 Ca 0.12 0.62 0.12 0.00 0.00 0.00 0.00 57.16 58.01 1ce8 n GLU 365 Cb 0.64 -1.89 0.12 0.00 0.00 0.00 0.00 31.44 30.31 1ce8 n GLU 365 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1ce8 n LYS 366 N -2.15 1.11 -3.94 3.44 5.02 0.46 -4.69 118.16 117.41 1ce8 n LYS 366 Ca -0.01 -0.85 -0.30 0.00 -2.02 0.00 0.00 58.31 55.13 1ce8 n LYS 366 Cb 0.03 -1.48 -0.14 0.00 -0.02 0.00 0.00 35.03 33.42 1ce8 n LYS 366 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1ce8 s PHE 367 N -2.47 3.18 0.00 2.13 0.08 0.50 -5.02 117.98 116.38 1ce8 s PHE 367 Ca 0.21 -3.05 0.00 0.00 0.12 0.00 0.00 56.93 54.21 1ce8 s PHE 367 Cb 0.19 -2.74 0.00 0.00 -0.57 0.00 0.00 43.02 39.89 1ce8 s PHE 367 CO 0.55 -0.79 0.09 0.00 -0.10 0.00 0.00 175.22 174.96 1ce8 n ALA 368 N 3.43 0.00 0.36 5.36 0.00 -1.26 -2.69 120.51 125.71 1ce8 n ALA 368 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1ce8 n ALA 368 Cb 0.35 0.04 0.12 0.00 0.00 0.00 0.00 19.45 19.96 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 -0.21 2.17 3.77 0.00 0.00 -1.26 -4.93 105.19 104.72 1ce8 n GLY 369 Ca 0.00 -0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.32 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 -1.46 3.31 0.07 4.61 0.00 -1.10 -4.45 121.76 122.73 1ce8 s ALA 370 Ca 0.18 0.94 -0.31 0.00 0.00 0.00 0.00 51.96 52.77 1ce8 s ALA 370 Cb 0.14 -3.35 -0.07 0.00 0.00 0.00 0.00 23.12 19.84 1ce8 s ALA 370 CO 0.05 -0.33 1.33 1.21 0.00 0.00 0.00 175.76 178.02 1ce8 s ASN 371 N -0.99 6.91 -0.22 0.00 3.84 -1.26 -4.91 114.94 118.30 1ce8 s ASN 371 Ca 0.50 2.17 0.14 0.00 0.21 0.00 0.00 52.86 55.89 1ce8 s ASN 371 Cb -0.31 -2.58 0.59 0.00 -0.55 0.00 0.00 41.25 38.40 1ce8 s ASN 371 CO 0.40 -0.62 1.52 -0.90 -2.79 0.00 0.00 177.10 174.72 1ce8 n ASP 372 N 4.33 4.03 -4.86 -4.21 5.68 -1.26 -4.96 116.55 115.29 1ce8 n ASP 372 Ca 0.11 -3.15 -0.34 0.00 -0.50 0.00 0.00 54.79 50.91 1ce8 n ASP 372 Cb 0.44 -0.60 -0.06 0.00 -1.14 0.00 0.00 41.12 39.76 1ce8 n ASP 372 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1ce8 s ARG 373 N -2.91 3.88 0.29 0.11 1.81 -1.26 -4.09 118.95 116.77 1ce8 s ARG 373 Ca 0.46 0.36 -0.27 0.00 -1.72 0.00 0.00 55.73 54.56 1ce8 s ARG 373 Cb 0.37 -2.82 -0.10 0.00 -0.45 0.00 0.00 34.95 31.96 1ce8 s ARG 373 CO 0.09 0.42 0.93 -0.51 -0.68 0.00 0.00 175.30 175.55 1ce8 s LEU 374 N -2.31 4.42 0.00 2.53 1.43 0.91 -4.95 118.68 120.72 1ce8 s LEU 374 Ca 0.41 1.84 0.00 0.00 -1.03 0.00 0.00 54.13 55.35 1ce8 s LEU 374 Cb -0.13 -3.87 0.00 0.00 0.03 0.00 0.00 46.19 42.21 1ce8 s LEU 374 CO 0.20 0.00 0.00 1.07 0.23 0.00 0.00 176.35 177.85 1ce8 n THR 375 N 0.83 0.00 0.41 5.49 5.66 -1.26 -4.84 114.28 120.56 1ce8 n THR 375 Ca 0.01 0.00 0.13 0.00 -3.05 0.00 0.00 64.05 61.14 1ce8 n THR 375 Cb 0.49 0.00 0.47 0.00 -1.55 0.00 0.00 70.33 69.74 1ce8 n THR 375 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 175.07 172.73 1ce8 h THR 376 N 0.28 0.00 -3.73 1.09 1.35 -1.89 -2.42 112.91 107.58 1ce8 h THR 376 Ca 0.00 -0.47 -0.64 0.00 -0.55 0.00 0.00 66.41 64.75 1ce8 h THR 376 Cb 0.00 1.37 -0.16 0.00 -1.73 0.00 0.00 68.15 67.63 1ce8 h THR 376 CO 0.00 0.00 -0.29 -1.58 -0.25 0.00 0.00 175.52 173.40 1ce8 s GLN 377 N -3.32 3.87 0.42 4.72 0.74 -1.26 -3.97 119.66 120.85 1ce8 s GLN 377 Ca 0.06 -0.15 -0.24 0.00 0.05 0.00 0.00 55.36 55.07 1ce8 s GLN 377 Cb 0.09 -3.70 -0.10 0.00 1.10 0.00 0.00 33.01 30.40 1ce8 s GLN 377 CO 0.52 -0.34 1.07 -1.33 -0.55 0.00 0.00 175.29 174.66 1ce8 n MET 378 N 5.31 1.47 0.00 1.67 2.81 -0.12 -4.92 117.12 123.35 1ce8 n MET 378 Ca -0.09 0.53 0.00 0.00 -1.81 0.00 0.00 57.70 56.32 1ce8 n MET 378 Cb 0.50 -2.12 0.00 0.00 -0.71 0.00 0.00 33.22 30.89 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 0.09 1.04 -2.35 0.03 5.02 -1.26 -4.90 118.16 115.83 1ce8 n LYS 379 Ca 0.09 -0.02 -0.33 0.00 -2.02 0.00 0.00 58.31 56.02 1ce8 n LYS 379 Cb 0.39 -0.21 -0.02 0.00 -0.02 0.00 0.00 35.03 35.17 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 -0.16 6.19 0.00 4.39 1.04 -1.26 -4.69 113.70 119.22 1ce8 s SER 380 Ca 0.00 1.83 0.14 0.00 0.48 0.00 0.00 55.95 58.40 1ce8 s SER 380 Cb 0.00 -2.54 0.01 0.00 0.10 0.00 0.00 66.02 63.59 1ce8 s SER 380 CO 0.00 -0.88 0.78 1.33 0.98 0.00 0.00 173.24 175.45 1ce8 n VAL 381 N -1.43 0.00 -3.24 5.02 0.24 0.18 -4.23 118.33 114.87 1ce8 n VAL 381 Ca 0.09 -0.38 0.00 0.00 -2.04 0.00 0.00 64.34 62.01 1ce8 n VAL 381 Cb 0.53 1.18 0.00 0.00 -1.47 0.00 0.00 33.84 34.07 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 1.00 1.10 3.59 7.63 0.00 -1.06 -4.48 105.19 112.97 1ce8 n GLY 382 Ca 0.06 -0.76 -0.08 0.00 0.00 0.00 0.00 46.02 45.25 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 -0.59 0.45 0.17 1.61 -1.05 -1.26 -1.17 118.70 116.87 1ce8 s GLU 383 Ca 0.00 0.06 0.11 0.00 -0.15 0.00 0.00 54.97 54.98 1ce8 s GLU 383 Cb 0.00 0.21 -0.04 0.00 -0.44 0.00 0.00 34.13 33.86 1ce8 s GLU 383 CO 0.00 -0.15 -0.21 0.54 0.95 0.00 0.00 175.26 176.38 1ce8 s VAL 384 N -1.36 2.55 0.05 1.83 0.11 -0.73 -4.18 120.40 118.65 1ce8 s VAL 384 Ca 0.02 -1.86 0.03 0.00 -2.93 0.00 0.00 61.98 57.25 1ce8 s VAL 384 Cb -0.01 -2.21 -0.02 0.00 -1.53 0.00 0.00 36.38 32.61 1ce8 s VAL 384 CO -0.02 -0.06 -0.11 -0.32 -3.33 0.00 0.00 175.10 171.27 1ce8 s MET 385 N -2.53 0.67 0.08 1.54 0.00 -0.64 -1.03 119.30 117.39 1ce8 s MET 385 Ca 0.20 -0.79 -0.10 0.00 0.00 0.00 0.00 55.69 55.00 1ce8 s MET 385 Cb -0.09 -0.56 0.00 0.00 0.00 0.00 0.00 34.83 34.19 1ce8 s MET 385 CO 0.10 0.12 0.21 0.00 0.00 0.00 0.00 175.02 175.45 1ce8 s ALA 386 N -1.21 -0.31 -0.01 4.11 0.00 -0.01 -4.82 121.76 119.51 1ce8 s ALA 386 Ca -0.05 -0.51 0.04 0.00 0.00 0.00 0.00 51.96 51.44 1ce8 s ALA 386 Cb -0.09 0.47 -0.01 0.00 0.00 0.00 0.00 23.12 23.49 1ce8 s ALA 386 CO 0.01 -0.50 -0.14 0.42 0.00 0.00 0.00 175.76 175.56 1ce8 s ILE 387 N -3.65 1.08 0.10 0.00 1.01 -1.26 -1.00 121.20 117.47 1ce8 s ILE 387 Ca 0.03 -0.61 -0.14 0.00 0.00 0.00 0.00 60.65 59.94 1ce8 s ILE 387 Cb 0.04 -0.90 0.02 0.00 0.01 0.00 0.00 42.46 41.63 1ce8 s ILE 387 CO -0.10 0.28 0.32 -0.83 0.00 0.00 0.00 174.94 174.62 1ce8 s GLY 388 N -0.37 -0.14 0.14 6.18 0.00 -0.98 -4.67 107.32 107.48 1ce8 s GLY 388 Ca 0.05 -0.19 0.20 0.00 0.00 0.00 0.00 44.72 44.78 1ce8 s GLY 388 CO -0.00 -0.42 1.60 0.54 0.00 0.00 0.00 173.10 174.82 1ce8 n ARG 389 N -0.02 0.11 -4.11 2.90 5.12 -1.26 -0.40 116.66 119.01 1ce8 n ARG 389 Ca -0.16 0.34 -0.09 0.00 -1.93 0.00 0.00 57.85 56.01 1ce8 n ARG 389 Cb 0.62 -1.71 -0.10 0.00 -1.16 0.00 0.00 32.46 30.11 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 -3.18 0.43 0.19 0.55 -4.23 -1.26 -4.56 115.64 103.58 1ce8 s THR 390 Ca 0.05 -1.67 -0.11 0.00 -1.18 0.00 0.00 61.69 58.78 1ce8 s THR 390 Cb 0.09 -1.34 0.11 0.00 1.34 0.00 0.00 72.50 72.71 1ce8 s THR 390 CO 0.34 -0.83 1.83 -0.61 -0.54 0.00 0.00 174.62 174.81 1ce8 h GLN 391 N 3.40 0.70 -0.36 3.99 5.75 -1.91 0.84 115.11 127.52 1ce8 h GLN 391 Ca -0.34 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.10 1ce8 h GLN 391 Cb 1.16 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 29.54 1ce8 h GLN 391 CO 0.60 0.47 0.18 1.96 -2.65 0.00 0.00 178.83 179.39 1ce8 h GLN 392 N 0.72 0.51 -0.57 1.69 4.20 -1.95 0.14 115.11 119.85 1ce8 h GLN 392 Ca 0.25 -0.07 -0.08 0.00 0.06 0.00 0.00 58.65 58.82 1ce8 h GLN 392 Cb 0.05 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.71 1ce8 h GLN 392 CO -0.12 0.44 0.05 1.49 -0.67 0.00 0.00 178.83 180.02 1ce8 h GLU 393 N 0.45 0.96 -0.14 1.46 4.81 -1.47 -2.01 114.58 118.64 1ce8 h GLU 393 Ca 0.12 -0.26 -0.02 0.00 -0.13 0.00 0.00 59.36 59.08 1ce8 h GLU 393 Cb 0.09 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1ce8 h GLU 393 CO -0.02 0.91 0.02 1.03 -0.73 0.00 0.00 179.01 180.22 1ce8 h SER 394 N 0.89 0.22 -0.05 1.04 0.87 0.13 -2.61 113.55 114.04 1ce8 h SER 394 Ca 0.17 -0.27 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 1ce8 h SER 394 Cb 0.46 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 62.36 1ce8 h SER 394 CO 0.02 0.44 0.03 0.25 -0.53 0.00 0.00 176.83 177.04 1ce8 h LEU 395 N -0.00 0.06 -1.33 2.23 5.85 -0.69 -1.84 115.31 119.59 1ce8 h LEU 395 Ca 0.04 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.70 1ce8 h LEU 395 Cb 0.31 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 1ce8 h LEU 395 CO 0.00 0.07 -0.01 1.56 -0.34 0.00 0.00 178.44 179.72 1ce8 h GLN 396 N 0.05 0.43 -0.36 1.25 4.20 -1.42 -1.66 115.11 117.60 1ce8 h GLN 396 Ca 0.02 -0.08 -0.11 0.00 0.06 0.00 0.00 58.65 58.53 1ce8 h GLN 396 Cb 0.01 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 1ce8 h GLN 396 CO -0.00 0.47 -0.22 0.87 -0.67 0.00 0.00 178.83 179.28 1ce8 h LYS 397 N 0.42 0.79 -0.57 1.46 1.57 -1.27 -2.11 116.57 116.86 1ce8 h LYS 397 Ca 0.09 -0.36 0.06 0.00 -1.87 0.00 0.00 60.65 58.57 1ce8 h LYS 397 Cb 0.29 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.53 1ce8 h LYS 397 CO 0.01 0.99 0.28 0.00 -0.57 0.00 0.00 179.45 180.16 1ce8 h ALA 398 N 0.78 0.74 -0.62 3.86 0.00 -0.84 -1.62 119.26 121.56 1ce8 h ALA 398 Ca 0.08 0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.09 1ce8 h ALA 398 Cb 0.78 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.45 1ce8 h ALA 398 CO 0.06 -0.08 0.31 -0.07 0.00 0.00 0.00 179.25 179.47 1ce8 h LEU 399 N 0.52 0.43 -0.00 0.00 3.38 -1.15 -0.10 115.31 118.39 1ce8 h LEU 399 Ca 0.26 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1ce8 h LEU 399 Cb 0.21 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1ce8 h LEU 399 CO -0.20 0.27 -0.00 -2.11 0.09 0.00 0.00 178.44 176.49 1ce8 n ARG 400 N -4.86 0.41 0.00 1.13 1.85 -0.81 -2.77 116.66 111.61 1ce8 n ARG 400 Ca 0.08 -0.00 0.09 0.00 -1.00 0.00 0.00 57.85 57.02 1ce8 n ARG 400 Cb 0.20 -1.50 0.02 0.00 -1.05 0.00 0.00 32.46 30.13 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 1.30 0.12 0.06 2.89 0.00 -0.19 -4.52 105.19 104.85 1ce8 n GLY 401 Ca 0.14 -0.55 0.07 0.00 0.00 0.00 0.00 46.02 45.68 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 0.19 0.24 -2.54 0.99 7.94 -0.38 -4.37 117.00 119.07 1ce8 n LEU 402 Ca 0.09 0.58 -0.21 0.00 -1.11 0.00 0.00 56.01 55.36 1ce8 n LEU 402 Cb 0.42 -0.57 -0.00 0.00 0.53 0.00 0.00 43.42 43.79 1ce8 n LEU 402 CO 0.21 -0.50 -0.21 -0.62 -1.11 0.00 0.00 177.39 175.16 1ce8 n GLU 403 N -1.79 -2.39 0.00 1.96 -0.58 -1.26 -4.79 120.64 111.78 1ce8 n GLU 403 Ca 0.01 0.98 0.06 0.00 -0.42 0.00 0.00 57.16 57.80 1ce8 n GLU 403 Cb 0.12 -5.69 0.00 0.00 -0.57 0.00 0.00 31.44 25.30 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 -4.10 0.00 0.00 2.62 0.24 -1.26 -4.97 118.33 110.86 1ce8 n VAL 404 Ca -0.22 -0.38 0.00 0.00 -2.04 0.00 0.00 64.34 61.71 1ce8 n VAL 404 Cb 0.67 1.16 0.00 0.00 -1.47 0.00 0.00 33.84 34.21 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 1.00 0.81 3.83 7.63 0.00 -1.26 -5.08 105.19 112.11 1ce8 n GLY 405 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.00 3.02 0.00 4.61 0.00 -1.26 -4.92 121.76 121.20 1ce8 s ALA 406 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 51.96 52.28 1ce8 s ALA 406 Cb 0.00 -3.15 0.00 0.00 0.00 0.00 0.00 23.12 19.97 1ce8 s ALA 406 CO 0.00 -0.12 0.66 0.25 0.00 0.00 0.00 175.76 176.55 1ce8 n THR 407 N -1.16 0.42 0.00 0.00 -2.24 -1.26 -4.49 114.28 105.54 1ce8 n THR 407 Ca 0.07 -0.60 0.00 0.00 -2.27 0.00 0.00 64.05 61.25 1ce8 n THR 407 Cb 0.54 0.89 0.00 0.00 -2.10 0.00 0.00 70.33 69.66 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 -0.21 0.20 2.44 3.38 0.00 -1.26 -4.32 105.19 105.41 1ce8 n GLY 408 Ca 0.00 -0.89 -0.40 0.00 0.00 0.00 0.00 46.02 44.74 1ce8 n GLY 408 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ce8 n PHE 409 N 0.00 2.59 -2.00 1.61 3.01 -1.26 -4.88 117.46 116.52 1ce8 n PHE 409 Ca 0.00 -2.96 -0.41 0.00 1.01 0.00 0.00 57.45 55.09 1ce8 n PHE 409 Cb 0.00 -2.19 -0.02 0.00 -0.01 0.00 0.00 39.48 37.27 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 1.38 6.63 0.40 4.37 1.01 -1.26 -4.96 116.67 124.24 1ce8 s ASP 410 Ca 0.60 2.78 -0.25 0.00 0.71 0.00 0.00 52.55 56.39 1ce8 s ASP 410 Cb 0.17 -2.65 -0.09 0.00 1.01 0.00 0.00 42.92 41.37 1ce8 s ASP 410 CO -0.07 -0.67 1.12 -2.16 0.21 0.00 0.00 175.17 173.60 1ce8 s PRO 411 N -1.49 4.11 -0.22 8.23 0.04 -1.26 -4.87 135.00 139.54 1ce8 s PRO 411 Ca 0.53 1.71 0.06 0.00 0.04 0.00 0.00 61.00 63.33 1ce8 s PRO 411 Cb -0.42 -2.64 -0.20 0.00 0.04 0.00 0.00 34.50 31.28 1ce8 s PRO 411 CO 0.53 -0.24 -0.05 1.17 0.04 0.00 0.00 177.00 178.46 1ce8 n LYS 412 N 0.05 0.67 -4.49 4.56 3.00 -1.26 -5.00 118.16 115.69 1ce8 n LYS 412 Ca 0.04 0.13 -0.24 0.00 -0.00 0.00 0.00 58.31 58.24 1ce8 n LYS 412 Cb 0.48 -1.55 -0.10 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 -2.52 2.33 0.30 3.15 -7.23 -1.26 -5.14 120.40 110.03 1ce8 s VAL 413 Ca -0.26 -2.32 -0.08 0.00 -1.81 0.00 0.00 61.98 57.51 1ce8 s VAL 413 Cb 0.08 -2.42 -0.06 0.00 0.56 0.00 0.00 36.38 34.53 1ce8 s VAL 413 CO 0.69 -0.33 0.62 -0.55 -0.31 0.00 0.00 175.10 175.22 1ce8 s SER 414 N -3.54 6.54 0.23 4.85 0.15 -1.26 -5.01 113.70 115.66 1ce8 s SER 414 Ca 0.31 0.92 -0.02 0.00 0.70 0.00 0.00 55.95 57.85 1ce8 s SER 414 Cb -0.02 -2.23 0.23 0.00 -1.71 0.00 0.00 66.02 62.29 1ce8 s SER 414 CO 0.15 -0.21 1.63 -0.07 1.20 0.00 0.00 173.24 175.94 1ce8 h LEU 415 N 1.87 0.67 -3.55 3.45 3.38 -1.99 -3.08 115.31 116.07 1ce8 h LEU 415 Ca -0.47 -0.26 -0.41 0.00 0.09 0.00 0.00 57.88 56.82 1ce8 h LEU 415 Cb 1.18 -0.19 -0.23 0.00 0.09 0.00 0.00 40.66 41.52 1ce8 h LEU 415 CO 0.66 0.93 0.53 -0.90 0.09 0.00 0.00 178.44 179.75 1ce8 n ASP 416 N -4.08 4.29 -4.38 -0.43 5.68 -1.26 -4.78 116.55 111.59 1ce8 n ASP 416 Ca -0.01 -3.25 -0.38 0.00 -0.50 0.00 0.00 54.79 50.65 1ce8 n ASP 416 Cb 0.46 -0.81 -0.12 0.00 -1.14 0.00 0.00 41.12 39.52 1ce8 n ASP 416 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1ce8 s ASP 417 N -0.75 5.40 0.47 -1.12 2.15 -1.16 -4.95 116.67 116.72 1ce8 s ASP 417 Ca 0.44 -0.70 0.14 0.00 0.43 0.00 0.00 52.55 52.86 1ce8 s ASP 417 Cb 0.36 -1.95 1.13 0.00 -0.30 0.00 0.00 42.92 42.16 1ce8 s ASP 417 CO 0.06 -0.23 2.07 -0.65 -0.17 0.00 0.00 175.17 176.25 1ce8 h PRO 418 N 8.31 0.23 0.00 4.34 0.11 -1.90 -1.56 132.00 141.53 1ce8 h PRO 418 Ca -0.30 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1ce8 h PRO 418 Cb 1.13 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1ce8 h PRO 418 CO 0.62 0.15 -0.17 0.93 -0.21 0.00 0.00 178.00 179.32 1ce8 h GLU 419 N 0.24 0.00 -0.57 1.05 4.39 -1.96 -3.39 114.58 114.34 1ce8 h GLU 419 Ca 0.14 0.00 0.10 0.00 0.34 0.00 0.00 59.36 59.94 1ce8 h GLU 419 Cb 0.25 0.00 -0.11 0.00 -0.10 0.00 0.00 28.75 28.79 1ce8 h GLU 419 CO -0.03 0.00 -0.33 0.00 -1.16 0.00 0.00 179.01 177.49 1ce8 h ALA 420 N 2.35 -0.07 0.00 3.43 0.00 -1.59 0.36 119.26 123.74 1ce8 h ALA 420 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1ce8 h ALA 420 Cb 0.83 0.78 0.00 0.00 0.00 0.00 0.00 17.79 19.39 1ce8 h ALA 420 CO 0.00 -0.69 0.18 1.28 0.00 0.00 0.00 179.25 180.02 1ce8 n LEU 421 N -5.43 0.43 -0.00 0.00 4.77 -1.26 -0.96 117.00 114.55 1ce8 n LEU 421 Ca 0.04 0.64 -0.21 0.00 -0.03 0.00 0.00 56.01 56.44 1ce8 n LEU 421 Cb 0.35 -0.63 -0.14 0.00 -2.33 0.00 0.00 43.42 40.67 1ce8 n LEU 421 CO 0.02 -0.78 -0.38 0.00 -1.33 0.00 0.00 177.39 174.91 1ce8 h THR 422 N 0.00 1.06 -0.37 -5.08 1.03 -0.59 -2.69 112.91 106.28 1ce8 h THR 422 Ca 0.00 -2.38 -0.04 0.00 -0.01 0.00 0.00 66.41 63.98 1ce8 h THR 422 Cb 0.36 2.72 -0.01 0.00 -1.07 0.00 0.00 68.15 70.14 1ce8 h THR 422 CO 0.00 0.67 0.07 0.11 -0.01 0.00 0.00 175.52 176.36 1ce8 h LYS 423 N -0.39 0.61 0.01 0.00 1.57 -1.04 -2.35 116.57 114.99 1ce8 h LYS 423 Ca -0.29 -0.16 0.01 0.00 -1.87 0.00 0.00 60.65 58.34 1ce8 h LYS 423 Cb 1.69 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.90 1ce8 h LYS 423 CO 0.04 0.67 -0.09 0.82 -0.57 0.00 0.00 179.45 180.32 1ce8 h ILE 424 N 0.46 0.77 -1.00 1.86 2.04 -1.18 0.29 117.51 120.75 1ce8 h ILE 424 Ca 0.11 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.08 1ce8 h ILE 424 Cb 0.35 0.77 -0.08 0.00 -0.74 0.00 0.00 36.82 37.12 1ce8 h ILE 424 CO 0.01 0.00 0.64 -0.09 0.00 0.00 0.00 178.15 178.70 1ce8 h ARG 425 N -0.16 1.02 -0.33 2.37 2.43 -1.34 -1.80 114.38 116.56 1ce8 h ARG 425 Ca 0.03 -0.06 -0.06 0.00 -0.81 0.00 0.00 59.98 59.08 1ce8 h ARG 425 Cb 0.20 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1ce8 h ARG 425 CO -0.09 0.68 -0.02 -0.09 -1.51 0.00 0.00 179.97 178.94 1ce8 h ARG 426 N 1.05 0.60 0.00 0.20 1.12 -1.00 -0.80 114.38 115.56 1ce8 h ARG 426 Ca 0.48 -0.20 -0.02 0.00 -1.11 0.00 0.00 59.98 59.12 1ce8 h ARG 426 Cb 0.38 -0.05 -0.00 0.00 -0.01 0.00 0.00 29.97 30.29 1ce8 h ARG 426 CO -0.24 0.75 -0.11 0.93 -3.11 0.00 0.00 179.97 178.19 1ce8 h GLU 427 N 0.40 0.00 0.05 0.20 4.39 -0.17 -1.94 114.58 117.51 1ce8 h GLU 427 Ca 0.09 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.60 1ce8 h GLU 427 Cb 0.49 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.12 1ce8 h GLU 427 CO 0.02 0.11 -1.01 -0.07 -1.16 0.00 0.00 179.01 176.90 1ce8 h LEU 428 N 0.00 0.15 -0.55 1.33 4.07 -1.14 -3.32 115.31 115.85 1ce8 h LEU 428 Ca -0.00 -0.77 -0.02 0.00 0.08 0.00 0.00 57.88 57.17 1ce8 h LEU 428 Cb 0.45 -0.05 -0.03 0.00 1.08 0.00 0.00 40.66 42.11 1ce8 h LEU 428 CO 0.01 1.42 0.26 0.50 -1.08 0.00 0.00 178.44 179.56 1ce8 h LYS 429 N -0.72 0.79 -3.23 1.13 3.64 -1.12 -3.37 116.57 113.70 1ce8 h LYS 429 Ca -0.25 -0.12 -0.61 0.00 -1.27 0.00 0.00 60.65 58.41 1ce8 h LYS 429 Cb 1.41 -0.14 -0.40 0.00 -0.41 0.00 0.00 32.23 32.69 1ce8 h LYS 429 CO -0.05 0.66 -0.74 -0.51 -2.27 0.00 0.00 179.45 176.54 1ce8 s ASP 430 N -5.95 3.83 0.35 4.20 1.01 -0.73 -4.89 116.67 114.49 1ce8 s ASP 430 Ca -0.13 -2.37 -0.29 0.00 0.71 0.00 0.00 52.55 50.47 1ce8 s ASP 430 Cb 0.12 -1.05 -0.11 0.00 1.01 0.00 0.00 42.92 42.90 1ce8 s ASP 430 CO 0.77 -0.31 1.49 0.00 0.21 0.00 0.00 175.17 177.34 1ce8 s ALA 431 N 0.67 3.61 0.00 5.23 0.00 -1.25 -4.57 121.76 125.45 1ce8 s ALA 431 Ca 0.15 1.54 0.00 0.00 0.00 0.00 0.00 51.96 53.65 1ce8 s ALA 431 Cb -0.23 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.29 1ce8 s ALA 431 CO -0.06 -0.99 0.00 0.41 0.00 0.00 0.00 175.76 175.12 1ce8 n GLY 432 N 0.92 4.39 0.24 0.00 0.00 -1.26 -0.06 105.19 109.42 1ce8 n GLY 432 Ca 0.03 -2.11 0.16 0.00 0.00 0.00 0.00 46.02 44.10 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 1.00 1.00 -0.01 4.61 0.00 -1.97 -3.20 119.26 120.70 1ce8 h ALA 433 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ce8 h ALA 433 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1ce8 h ALA 433 CO 0.00 0.00 -0.31 -0.25 0.00 0.00 0.00 179.25 178.69 1ce8 n ASP 434 N -2.83 1.36 -0.33 0.00 8.00 -1.26 -4.63 116.55 116.87 1ce8 n ASP 434 Ca 0.01 -1.11 0.11 0.00 0.71 0.00 0.00 54.79 54.51 1ce8 n ASP 434 Cb 0.27 0.23 0.24 0.00 -0.02 0.00 0.00 41.12 41.84 1ce8 n ASP 434 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 1ce8 h ARG 435 N 1.65 0.03 -0.85 -1.24 2.43 -1.81 -1.73 114.38 112.86 1ce8 h ARG 435 Ca 0.00 -0.00 0.17 0.00 -0.81 0.00 0.00 59.98 59.34 1ce8 h ARG 435 Cb 0.59 -0.01 -0.10 0.00 -0.42 0.00 0.00 29.97 30.03 1ce8 h ARG 435 CO 0.00 0.02 0.41 0.97 -1.51 0.00 0.00 179.97 179.86 1ce8 h ILE 436 N 0.03 0.63 0.00 1.20 6.09 -1.88 0.31 117.51 123.90 1ce8 h ILE 436 Ca 0.54 -0.18 -0.03 0.00 -1.37 0.00 0.00 64.86 63.82 1ce8 h ILE 436 Cb 1.05 0.06 -0.00 0.00 0.47 0.00 0.00 36.82 38.40 1ce8 h ILE 436 CO -0.89 0.10 -0.14 -0.50 -3.07 0.00 0.00 178.15 173.64 1ce8 h TRP 437 N 0.53 0.00 0.00 2.19 6.55 -1.65 -3.09 115.95 120.48 1ce8 h TRP 437 Ca 0.49 0.00 -0.18 0.00 0.95 0.00 0.00 58.89 60.15 1ce8 h TRP 437 Cb 0.79 0.00 -0.02 0.00 -0.86 0.00 0.00 29.16 29.06 1ce8 h TRP 437 CO -0.12 0.14 -0.84 1.88 -1.05 0.00 0.00 178.44 178.46 1ce8 h TYR 438 N 0.00 0.04 -0.62 0.49 0.05 -0.29 -2.45 116.97 114.19 1ce8 h TYR 438 Ca -0.00 -0.02 0.01 0.00 0.05 0.00 0.00 58.73 58.76 1ce8 h TYR 438 Cb 0.92 -0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.63 1ce8 h TYR 438 CO 0.00 0.85 0.40 0.82 -1.05 0.00 0.00 178.16 179.19 1ce8 h ILE 439 N 0.01 1.15 -0.18 -2.88 2.04 -1.07 0.20 117.51 116.79 1ce8 h ILE 439 Ca -0.01 -0.28 -0.03 0.00 1.00 0.00 0.00 64.86 65.53 1ce8 h ILE 439 Cb 1.48 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 1ce8 h ILE 439 CO 0.11 0.15 -0.00 0.00 0.00 0.00 0.00 178.15 178.41 1ce8 h ALA 440 N 1.23 0.24 -0.30 1.87 0.00 -1.58 -2.74 119.26 117.99 1ce8 h ALA 440 Ca 0.23 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1ce8 h ALA 440 Cb -0.08 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1ce8 h ALA 440 CO -0.06 -0.04 0.20 -0.44 0.00 0.00 0.00 179.25 178.91 1ce8 h ASP 441 N 0.07 0.25 -0.56 0.00 3.32 -0.98 -0.78 116.42 117.74 1ce8 h ASP 441 Ca 0.05 -0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.02 1ce8 h ASP 441 Cb 0.39 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 1ce8 h ASP 441 CO 0.01 0.18 0.06 0.00 -1.72 0.00 0.00 179.24 177.77 1ce8 h ALA 442 N 1.83 0.75 -0.28 3.45 0.00 -0.36 -1.36 119.26 123.28 1ce8 h ALA 442 Ca 0.12 -0.26 -0.15 0.00 0.00 0.00 0.00 54.91 54.62 1ce8 h ALA 442 Cb 0.12 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1ce8 h ALA 442 CO -0.03 0.52 -0.43 0.74 0.00 0.00 0.00 179.25 180.05 1ce8 h PHE 443 N 0.83 0.86 0.00 0.00 0.04 -1.01 -0.61 116.94 117.05 1ce8 h PHE 443 Ca 0.17 -0.27 -0.04 0.00 2.80 0.00 0.00 57.97 60.63 1ce8 h PHE 443 Cb 0.45 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.42 1ce8 h PHE 443 CO 0.03 1.02 -0.18 0.00 -0.60 0.00 0.00 178.31 178.59 1ce8 h ARG 444 N 0.58 0.00 -0.16 1.51 3.08 -1.03 -2.66 114.38 115.70 1ce8 h ARG 444 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1ce8 h ARG 444 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.03 1ce8 h ARG 444 CO 0.09 0.18 0.00 0.00 -1.07 0.00 0.00 179.97 179.17 1ce8 n ALA 445 N -2.47 2.53 -0.12 0.04 0.00 -0.53 -4.93 120.51 115.03 1ce8 n ALA 445 Ca -0.02 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.94 1ce8 n ALA 445 Cb 0.24 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.59 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 1.08 0.75 3.78 0.00 0.00 -1.00 -5.04 105.19 104.76 1ce8 n GLY 446 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 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 4.33 0.74 0.99 1.43 -0.31 -5.02 118.68 120.84 1ce8 s LEU 447 Ca 0.00 1.92 -0.07 0.00 -1.03 0.00 0.00 54.13 54.95 1ce8 s LEU 447 Cb 0.00 -4.00 0.09 0.00 0.03 0.00 0.00 46.19 42.31 1ce8 s LEU 447 CO 0.00 -0.15 1.05 -0.94 0.23 0.00 0.00 176.35 176.54 1ce8 s SER 448 N -1.52 4.56 0.17 2.29 1.04 -1.26 -4.54 113.70 114.44 1ce8 s SER 448 Ca 0.51 0.32 -0.10 0.00 0.48 0.00 0.00 55.95 57.16 1ce8 s SER 448 Cb -0.21 -0.87 0.06 0.00 0.10 0.00 0.00 66.02 65.10 1ce8 s SER 448 CO 0.26 -1.76 1.65 0.58 0.98 0.00 0.00 173.24 174.95 1ce8 h VAL 449 N -0.71 1.26 -0.75 5.02 2.07 -1.97 -0.83 116.25 120.34 1ce8 h VAL 449 Ca -0.43 -1.05 -0.03 0.00 0.82 0.00 0.00 66.70 66.01 1ce8 h VAL 449 Cb 1.30 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 31.81 1ce8 h VAL 449 CO 0.55 0.38 0.35 0.44 0.02 0.00 0.00 177.57 179.31 1ce8 h ASP 450 N 0.91 1.00 -0.17 0.57 3.32 -1.98 0.25 116.42 120.30 1ce8 h ASP 450 Ca 0.18 -0.14 0.04 0.00 0.02 0.00 0.00 57.03 57.12 1ce8 h ASP 450 Cb 0.47 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.73 1ce8 h ASP 450 CO 0.02 0.86 -0.05 1.23 -1.72 0.00 0.00 179.24 179.58 1ce8 h GLY 451 N 1.06 0.12 0.96 2.75 0.00 -1.82 0.11 103.07 106.25 1ce8 h GLY 451 Ca 0.26 0.06 -0.02 0.00 0.00 0.00 0.00 47.33 47.63 1ce8 h GLY 451 CO -0.03 -0.07 0.19 -2.08 0.00 0.00 0.00 176.54 174.56 1ce8 h VAL 452 N -0.01 1.18 -0.14 4.60 2.07 -0.88 -2.86 116.25 120.22 1ce8 h VAL 452 Ca 0.08 -0.52 0.04 0.00 0.82 0.00 0.00 66.70 67.13 1ce8 h VAL 452 Cb 0.13 0.75 -0.05 0.00 -1.52 0.00 0.00 31.29 30.61 1ce8 h VAL 452 CO -0.18 0.20 -0.15 0.15 0.02 0.00 0.00 177.57 177.61 1ce8 h PHE 453 N 0.53 -0.37 -0.39 1.57 3.57 0.07 -1.11 116.94 120.81 1ce8 h PHE 453 Ca 0.14 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.75 1ce8 h PHE 453 Cb 0.13 0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 1ce8 h PHE 453 CO -0.01 -0.22 0.27 -0.91 -2.23 0.00 0.00 178.31 175.22 1ce8 h ASN 454 N -0.18 0.12 0.55 0.41 2.35 -0.70 0.55 115.58 118.69 1ce8 h ASN 454 Ca 0.10 0.00 -0.28 0.00 -0.55 0.00 0.00 56.30 55.57 1ce8 h ASN 454 Cb 0.32 -0.02 -0.04 0.00 0.05 0.00 0.00 38.32 38.62 1ce8 h ASN 454 CO -0.25 0.07 -1.59 -0.07 -1.65 0.00 0.00 177.43 173.94 1ce8 h LEU 455 N 0.13 0.05 0.00 1.61 3.38 -1.06 -3.41 115.31 116.02 1ce8 h LEU 455 Ca 0.18 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1ce8 h LEU 455 Cb 0.55 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 1ce8 h LEU 455 CO -0.02 1.08 -1.63 0.35 0.09 0.00 0.00 178.44 178.31 1ce8 n THR 456 N -3.15 0.10 -1.52 0.22 -2.24 -0.52 -3.94 114.28 103.23 1ce8 n THR 456 Ca -0.15 -0.33 -0.18 0.00 -2.27 0.00 0.00 64.05 61.12 1ce8 n THR 456 Cb 1.03 0.10 -0.08 0.00 -2.10 0.00 0.00 70.33 69.28 1ce8 n THR 456 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1ce8 n ASN 457 N -2.02 -5.36 -4.71 3.42 4.13 0.19 -4.64 115.26 106.28 1ce8 n ASN 457 Ca -0.04 0.45 -0.40 0.00 1.68 0.00 0.00 54.58 56.26 1ce8 n ASN 457 Cb 0.41 -4.44 -0.05 0.00 -1.54 0.00 0.00 39.78 34.16 1ce8 n ASN 457 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1ce8 s ILE 458 N -2.60 5.02 0.14 2.41 1.01 -1.26 -4.47 121.20 121.44 1ce8 s ILE 458 Ca 0.00 1.47 -0.34 0.00 0.00 0.00 0.00 60.65 61.78 1ce8 s ILE 458 Cb 0.00 -4.06 -0.16 0.00 0.01 0.00 0.00 42.46 38.25 1ce8 s ILE 458 CO 0.00 0.22 1.21 -0.67 0.00 0.00 0.00 174.94 175.70 1ce8 n ASP 459 N 3.98 1.35 0.16 3.58 -0.08 -1.26 -4.73 116.55 119.55 1ce8 n ASP 459 Ca -0.00 1.13 0.18 0.00 -1.51 0.00 0.00 54.79 54.59 1ce8 n ASP 459 Cb 0.51 -1.19 0.80 0.00 2.34 0.00 0.00 41.12 43.57 1ce8 n ASP 459 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 1ce8 h ARG 460 N 3.70 0.00 -0.98 -0.67 3.08 -1.94 0.11 114.38 117.68 1ce8 h ARG 460 Ca -0.45 0.00 0.12 0.00 0.07 0.00 0.00 59.98 59.73 1ce8 h ARG 460 Cb 1.35 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 31.31 1ce8 h ARG 460 CO 0.72 0.00 0.62 2.35 -1.07 0.00 0.00 179.97 182.59 1ce8 h TRP 461 N 0.00 1.08 0.16 3.04 7.01 -2.01 0.23 115.95 125.47 1ce8 h TRP 461 Ca 0.12 0.03 -0.26 0.00 2.11 0.00 0.00 58.89 60.89 1ce8 h TRP 461 Cb 0.70 -0.34 0.02 0.00 -2.10 0.00 0.00 29.16 27.44 1ce8 h TRP 461 CO 0.00 0.43 -1.24 0.74 -2.79 0.00 0.00 178.44 175.58 1ce8 h PHE 462 N 0.94 0.63 -0.08 2.65 0.04 -1.13 -3.35 116.94 116.63 1ce8 h PHE 462 Ca 0.49 -0.46 0.04 0.00 2.80 0.00 0.00 57.97 60.84 1ce8 h PHE 462 Cb 0.53 -0.03 -0.05 0.00 2.20 0.00 0.00 35.95 38.60 1ce8 h PHE 462 CO -0.00 1.48 -0.26 -0.07 -0.60 0.00 0.00 178.31 178.86 1ce8 h LEU 463 N -0.19 -0.78 -1.69 1.54 3.38 -0.88 -1.67 115.31 115.02 1ce8 h LEU 463 Ca -0.24 0.12 0.19 0.00 0.09 0.00 0.00 57.88 58.04 1ce8 h LEU 463 Cb 1.84 0.33 -0.05 0.00 0.09 0.00 0.00 40.66 42.87 1ce8 h LEU 463 CO 0.15 -0.31 0.54 -0.37 0.09 0.00 0.00 178.44 178.54 1ce8 h VAL 464 N -0.35 0.70 -0.05 1.22 -1.51 -1.16 0.23 116.25 115.34 1ce8 h VAL 464 Ca 0.09 -0.10 -0.14 0.00 -1.23 0.00 0.00 66.70 65.32 1ce8 h VAL 464 Cb 0.48 0.40 -0.01 0.00 -2.13 0.00 0.00 31.29 30.02 1ce8 h VAL 464 CO -0.28 0.05 -0.62 1.56 -1.23 0.00 0.00 177.57 177.05 1ce8 h GLN 465 N 0.28 0.17 -0.05 5.19 4.20 -1.44 -2.08 115.11 121.37 1ce8 h GLN 465 Ca 0.40 -0.12 -0.19 0.00 0.06 0.00 0.00 58.65 58.80 1ce8 h GLN 465 Cb 1.13 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.93 1ce8 h GLN 465 CO -0.10 0.73 -0.78 0.82 -0.67 0.00 0.00 178.83 178.83 1ce8 h ILE 466 N 0.12 1.40 -0.65 2.54 2.04 -0.23 -2.62 117.51 120.12 1ce8 h ILE 466 Ca -0.01 -2.25 -0.04 0.00 1.00 0.00 0.00 64.86 63.56 1ce8 h ILE 466 Cb 1.12 2.21 -0.03 0.00 -0.74 0.00 0.00 36.82 39.38 1ce8 h ILE 466 CO 0.09 0.67 0.26 -0.08 0.00 0.00 0.00 178.15 179.09 1ce8 h GLU 467 N 0.23 0.95 -0.60 2.37 4.81 -1.08 -1.81 114.58 119.44 1ce8 h GLU 467 Ca -0.04 -0.15 -0.10 0.00 -0.13 0.00 0.00 59.36 58.94 1ce8 h GLU 467 Cb 1.36 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.56 1ce8 h GLU 467 CO 0.13 0.77 -0.01 1.49 -0.73 0.00 0.00 179.01 180.66 1ce8 h GLU 468 N 0.93 1.07 -0.76 1.92 4.81 -1.24 -1.19 114.58 120.12 1ce8 h GLU 468 Ca 0.22 -0.34 0.01 0.00 -0.13 0.00 0.00 59.36 59.12 1ce8 h GLU 468 Cb 0.18 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.43 1ce8 h GLU 468 CO -0.02 1.05 0.50 -0.07 -0.73 0.00 0.00 179.01 179.74 1ce8 h LEU 469 N 0.97 0.86 0.16 1.64 3.38 -1.01 -0.81 115.31 120.51 1ce8 h LEU 469 Ca 0.17 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1ce8 h LEU 469 Cb 0.57 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1ce8 h LEU 469 CO 0.03 0.62 -0.08 0.58 0.09 0.00 0.00 178.44 179.68 1ce8 h VAL 470 N 1.01 0.91 -0.84 1.22 2.07 -0.54 0.12 116.25 120.21 1ce8 h VAL 470 Ca 0.28 -0.34 0.09 0.00 0.82 0.00 0.00 66.70 67.55 1ce8 h VAL 470 Cb -0.09 1.13 -0.06 0.00 -1.52 0.00 0.00 31.29 30.75 1ce8 h VAL 470 CO -0.07 0.08 0.54 0.03 0.02 0.00 0.00 177.57 178.18 1ce8 h ARG 471 N -0.39 0.81 -0.42 1.57 2.47 -0.98 0.28 114.38 117.71 1ce8 h ARG 471 Ca -0.02 -0.05 -0.08 0.00 -1.26 0.00 0.00 59.98 58.57 1ce8 h ARG 471 Cb 0.30 -0.18 -0.02 0.00 -1.65 0.00 0.00 29.97 28.42 1ce8 h ARG 471 CO 0.04 0.53 -0.06 -0.07 0.56 0.00 0.00 179.97 180.97 1ce8 h LEU 472 N 0.83 0.70 -0.68 3.04 3.38 -0.69 -1.34 115.31 120.55 1ce8 h LEU 472 Ca 0.38 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 1ce8 h LEU 472 Cb 0.38 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1ce8 h LEU 472 CO -0.15 0.80 0.20 -0.33 0.09 0.00 0.00 178.44 179.05 1ce8 h GLU 473 N 0.67 1.08 -0.69 1.13 5.08 0.15 -0.96 114.58 121.04 1ce8 h GLU 473 Ca 0.12 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1ce8 h GLU 473 Cb 0.49 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 1ce8 h GLU 473 CO 0.03 0.94 0.42 0.93 -1.00 0.00 0.00 179.01 180.33 1ce8 h GLU 474 N 1.01 0.93 -0.48 2.33 5.08 -0.45 0.09 114.58 123.10 1ce8 h GLU 474 Ca 0.22 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1ce8 h GLU 474 Cb 0.33 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 1ce8 h GLU 474 CO -0.00 0.66 0.27 -0.22 -1.00 0.00 0.00 179.01 178.72 1ce8 h LYS 475 N 0.94 0.66 -0.20 2.33 3.64 -0.74 -0.44 116.57 122.76 1ce8 h LYS 475 Ca 0.25 -0.07 0.01 0.00 -1.27 0.00 0.00 60.65 59.56 1ce8 h LYS 475 Cb -0.04 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.64 1ce8 h LYS 475 CO -0.05 0.51 0.12 0.28 -2.27 0.00 0.00 179.45 178.04 1ce8 h VAL 476 N 0.64 1.03 -0.36 2.00 2.07 -0.53 -0.03 116.25 121.06 1ce8 h VAL 476 Ca 0.17 -0.08 0.02 0.00 0.82 0.00 0.00 66.70 67.63 1ce8 h VAL 476 Cb 0.03 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 1ce8 h VAL 476 CO -0.03 0.05 0.24 0.00 0.02 0.00 0.00 177.57 177.85 1ce8 h ALA 477 N 1.09 1.85 0.15 1.67 0.00 -0.67 0.15 119.26 123.50 1ce8 h ALA 477 Ca 0.08 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ce8 h ALA 477 Cb -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1ce8 h ALA 477 CO -0.04 0.11 -0.07 1.49 0.00 0.00 0.00 179.25 180.74 1ce8 h GLU 478 N 0.39 -0.20 0.00 0.00 4.57 -0.10 -3.30 114.58 115.94 1ce8 h GLU 478 Ca 0.14 0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.34 1ce8 h GLU 478 Cb 0.09 0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 28.72 1ce8 h GLU 478 CO -0.03 0.22 -0.01 -0.39 -1.18 0.00 0.00 179.01 177.62 1ce8 h VAL 479 N -0.72 0.01 -1.94 0.32 -1.51 -0.81 -3.50 116.25 108.11 1ce8 h VAL 479 Ca -0.02 -0.94 0.18 0.00 -1.23 0.00 0.00 66.70 64.69 1ce8 h VAL 479 Cb 0.51 1.93 -0.04 0.00 -2.13 0.00 0.00 31.29 31.56 1ce8 h VAL 479 CO 0.03 0.01 -0.23 0.61 -1.23 0.00 0.00 177.57 176.76 1ce8 n GLY 480 N 0.93 -1.75 0.33 5.19 0.00 0.51 -2.64 105.19 107.77 1ce8 n GLY 480 Ca 0.03 -1.22 0.18 0.00 0.00 0.00 0.00 46.02 45.02 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 -0.60 0.27 0.00 -0.61 2.10 -1.84 -0.75 117.51 116.08 1ce8 h ILE 481 Ca 0.01 0.00 -0.18 0.00 1.08 0.00 0.00 64.86 65.77 1ce8 h ILE 481 Cb 0.59 0.91 -0.03 0.00 -1.09 0.00 0.00 36.82 37.20 1ce8 h ILE 481 CO 0.00 0.00 -0.87 0.71 -1.08 0.00 0.00 178.15 176.91 1ce8 h THR 482 N 0.00 1.53 0.00 2.19 1.35 -1.97 -2.80 112.91 113.20 1ce8 h THR 482 Ca 0.03 -3.10 0.00 0.00 -0.55 0.00 0.00 66.41 62.79 1ce8 h THR 482 Cb 0.24 2.72 0.00 0.00 -1.73 0.00 0.00 68.15 69.38 1ce8 h THR 482 CO -0.00 0.86 0.00 0.61 -0.25 0.00 0.00 175.52 176.74 1ce8 n GLY 483 N 1.26 -1.03 2.70 5.82 0.00 -0.30 -4.32 105.19 109.32 1ce8 n GLY 483 Ca 0.00 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.26 7.20 -4.82 0.99 4.77 -1.06 -4.86 117.00 117.97 1ce8 n LEU 484 Ca 0.12 -4.56 -0.32 0.00 -0.03 0.00 0.00 56.01 51.22 1ce8 n LEU 484 Cb 0.18 -1.50 0.02 0.00 -2.33 0.00 0.00 43.42 39.78 1ce8 n LEU 484 CO 0.17 1.53 0.71 0.54 -1.33 0.00 0.00 177.39 179.01 1ce8 s ASN 485 N 1.39 5.79 0.44 -1.43 2.20 -1.26 -4.70 114.94 117.37 1ce8 s ASN 485 Ca 0.47 1.69 0.23 0.00 -0.94 0.00 0.00 52.86 54.31 1ce8 s ASN 485 Cb 0.13 -2.51 1.21 0.00 -2.00 0.00 0.00 41.25 38.08 1ce8 s ASN 485 CO -0.04 -1.16 1.82 0.00 -2.94 0.00 0.00 177.10 174.77 1ce8 h ALA 486 N 0.07 2.44 0.22 3.54 0.00 -1.97 0.31 119.26 123.87 1ce8 h ALA 486 Ca -0.46 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 1ce8 h ALA 486 Cb 1.21 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1ce8 h ALA 486 CO 0.58 -0.78 -0.10 -0.44 0.00 0.00 0.00 179.25 178.51 1ce8 h ASP 487 N 0.29 -0.25 -0.39 0.00 3.32 -1.98 -1.86 116.42 115.56 1ce8 h ASP 487 Ca 0.53 -0.24 -0.02 0.00 0.02 0.00 0.00 57.03 57.32 1ce8 h ASP 487 Cb 1.55 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 41.15 1ce8 h ASP 487 CO -0.18 0.14 0.15 0.15 -1.72 0.00 0.00 179.24 177.79 1ce8 h PHE 488 N -0.68 0.59 -0.89 4.55 3.57 -1.68 -1.39 116.94 121.01 1ce8 h PHE 488 Ca -0.03 -0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.47 1ce8 h PHE 488 Cb 0.47 -0.18 -0.05 0.00 2.79 0.00 0.00 35.95 38.98 1ce8 h PHE 488 CO 0.04 0.53 0.59 1.25 -2.23 0.00 0.00 178.31 178.48 1ce8 h LEU 489 N 0.48 0.94 -0.87 0.59 5.85 -0.48 -1.65 115.31 120.18 1ce8 h LEU 489 Ca 0.13 -0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.74 1ce8 h LEU 489 Cb 0.19 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 1ce8 h LEU 489 CO -0.01 0.63 -0.34 -0.09 -0.34 0.00 0.00 178.44 178.29 1ce8 h ARG 490 N 1.08 0.44 -0.22 1.25 2.43 -0.90 -0.81 114.38 117.65 1ce8 h ARG 490 Ca 0.37 -0.19 -0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1ce8 h ARG 490 Cb 0.08 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1ce8 h ARG 490 CO -0.12 0.72 0.13 0.37 -1.51 0.00 0.00 179.97 179.57 1ce8 h GLN 491 N 0.37 0.30 -0.10 0.20 4.15 -0.43 -0.44 115.11 119.15 1ce8 h GLN 491 Ca 0.04 -0.03 0.02 0.00 0.77 0.00 0.00 58.65 59.46 1ce8 h GLN 491 Cb 0.78 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.38 1ce8 h GLN 491 CO 0.06 0.24 -0.02 -0.07 -1.93 0.00 0.00 178.83 177.11 1ce8 h LEU 492 N 0.27 -0.09 -0.84 -2.39 3.38 -1.07 -2.12 115.31 112.45 1ce8 h LEU 492 Ca 0.08 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1ce8 h LEU 492 Cb 0.02 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 1ce8 h LEU 492 CO -0.01 -0.03 0.54 0.11 0.09 0.00 0.00 178.44 179.13 1ce8 h LYS 493 N 0.00 1.12 0.00 1.13 1.79 -0.98 -1.09 116.57 118.54 1ce8 h LYS 493 Ca 0.05 -0.08 -0.01 0.00 -2.18 0.00 0.00 60.65 58.43 1ce8 h LYS 493 Cb 0.07 -0.24 -0.00 0.00 -1.58 0.00 0.00 32.23 30.48 1ce8 h LYS 493 CO -0.10 0.76 -0.06 0.00 -1.08 0.00 0.00 179.45 178.97 1ce8 h ARG 494 N 1.14 0.00 -0.24 3.15 3.08 -0.54 -0.65 114.38 120.33 1ce8 h ARG 494 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 1ce8 h ARG 494 Cb -0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.95 1ce8 h ARG 494 CO -0.06 0.06 0.00 1.63 -1.07 0.00 0.00 179.97 180.52 1ce8 n LYS 495 N -3.39 1.83 -0.57 0.04 4.76 -0.51 -4.51 118.16 115.82 1ce8 n LYS 495 Ca -0.02 -1.26 0.00 0.00 -2.87 0.00 0.00 58.31 54.16 1ce8 n LYS 495 Cb 0.20 -1.38 0.00 0.00 -1.84 0.00 0.00 35.03 32.01 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 1.16 0.76 3.73 0.72 0.00 -0.25 -3.52 105.19 107.78 1ce8 n GLY 496 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1ce8 n GLY 496 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ce8 s PHE 497 N -2.76 2.99 0.43 1.61 0.08 -0.61 -4.50 117.98 115.21 1ce8 s PHE 497 Ca 0.00 0.71 -0.22 0.00 0.12 0.00 0.00 56.93 57.54 1ce8 s PHE 497 Cb 0.00 -3.95 -0.10 0.00 -0.57 0.00 0.00 43.02 38.40 1ce8 s PHE 497 CO 0.00 -3.38 0.97 0.00 -0.10 0.00 0.00 175.22 172.72 1ce8 s ALA 498 N 0.70 3.03 0.31 5.36 0.00 -1.26 -4.56 121.76 125.35 1ce8 s ALA 498 Ca 0.67 0.48 0.04 0.00 0.00 0.00 0.00 51.96 53.15 1ce8 s ALA 498 Cb -0.45 -3.18 0.65 0.00 0.00 0.00 0.00 23.12 20.14 1ce8 s ALA 498 CO 0.37 0.02 1.86 -0.44 0.00 0.00 0.00 175.76 177.57 1ce8 h ASP 499 N 2.04 0.82 -0.62 0.00 3.32 -1.92 -1.09 116.42 118.97 1ce8 h ASP 499 Ca -0.49 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 56.60 1ce8 h ASP 499 Cb 1.19 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 40.59 1ce8 h ASP 499 CO 0.61 0.44 0.38 0.00 -1.72 0.00 0.00 179.24 178.95 1ce8 h ALA 500 N 1.56 0.78 -0.27 3.45 0.00 -1.91 0.47 119.26 123.34 1ce8 h ALA 500 Ca 0.46 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 55.12 1ce8 h ALA 500 Cb 0.54 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1ce8 h ALA 500 CO -0.23 0.25 -0.56 -0.09 0.00 0.00 0.00 179.25 178.63 1ce8 h ARG 501 N 0.83 0.83 -0.64 0.00 9.65 -1.43 -1.17 114.38 122.46 1ce8 h ARG 501 Ca 0.22 -0.54 -0.07 0.00 -1.10 0.00 0.00 59.98 58.49 1ce8 h ARG 501 Cb -0.04 0.07 -0.03 0.00 -1.39 0.00 0.00 29.97 28.58 1ce8 h ARG 501 CO -0.04 1.17 0.12 -0.07 2.80 0.00 0.00 179.97 183.94 1ce8 h LEU 502 N 0.64 1.00 0.12 3.80 3.38 -0.86 -1.98 115.31 121.41 1ce8 h LEU 502 Ca 0.01 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.75 1ce8 h LEU 502 Cb 1.16 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.60 1ce8 h LEU 502 CO 0.12 1.00 -0.44 0.00 0.09 0.00 0.00 178.44 179.22 1ce8 h ALA 503 N 1.04 -0.78 -0.81 1.53 0.00 0.08 0.26 119.26 120.57 1ce8 h ALA 503 Ca 0.20 -0.08 0.13 0.00 0.00 0.00 0.00 54.91 55.16 1ce8 h ALA 503 Cb 0.42 0.73 -0.09 0.00 0.00 0.00 0.00 17.79 18.85 1ce8 h ALA 503 CO 0.01 -1.01 0.41 0.87 0.00 0.00 0.00 179.25 179.53 1ce8 h LYS 504 N -0.67 0.60 -0.41 0.00 1.57 -0.94 0.66 116.57 117.38 1ce8 h LYS 504 Ca 0.02 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.64 1ce8 h LYS 504 Cb 0.69 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 1ce8 h LYS 504 CO -0.25 0.40 -0.21 -0.07 -0.57 0.00 0.00 179.45 178.75 1ce8 h LEU 505 N 0.62 0.88 0.00 2.94 3.38 -0.56 -2.77 115.31 119.79 1ce8 h LEU 505 Ca 0.43 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1ce8 h LEU 505 Cb 0.57 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1ce8 h LEU 505 CO -0.34 1.10 0.00 0.00 0.09 0.00 0.00 178.44 179.29 1ce8 n ALA 506 N -2.49 2.27 -3.01 1.53 0.00 0.83 -4.42 120.51 115.22 1ce8 n ALA 506 Ca -0.01 -0.11 -0.12 0.00 0.00 0.00 0.00 53.44 53.20 1ce8 n ALA 506 Cb 0.44 -1.43 0.05 0.00 0.00 0.00 0.00 19.45 18.50 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 1.14 0.02 3.37 0.00 0.00 0.11 -4.42 105.19 105.41 1ce8 n GLY 507 Ca 0.09 -0.13 -0.21 0.00 0.00 0.00 0.00 46.02 45.77 1ce8 n GLY 507 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ce8 s VAL 508 N -3.20 0.29 0.60 1.61 -7.23 -0.51 -5.01 120.40 106.94 1ce8 s VAL 508 Ca 0.19 -2.00 -0.13 0.00 -1.81 0.00 0.00 61.98 58.23 1ce8 s VAL 508 Cb -0.09 -2.46 -0.04 0.00 0.56 0.00 0.00 36.38 34.35 1ce8 s VAL 508 CO 0.43 0.00 1.03 -0.13 -0.31 0.00 0.00 175.10 176.12 1ce8 s ARG 509 N -3.68 3.55 0.38 4.82 3.00 -1.26 -4.13 118.95 121.62 1ce8 s ARG 509 Ca 0.34 0.90 0.06 0.00 0.00 0.00 0.00 55.73 57.03 1ce8 s ARG 509 Cb 0.03 -2.07 0.74 0.00 0.00 0.00 0.00 34.95 33.66 1ce8 s ARG 509 CO 0.20 -0.61 1.99 1.49 0.00 0.00 0.00 175.30 178.37 1ce8 h GLU 510 N 0.06 0.57 0.00 3.54 4.81 -1.90 -1.29 114.58 120.36 1ce8 h GLU 510 Ca -0.45 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 58.69 1ce8 h GLU 510 Cb 1.20 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.46 1ce8 h GLU 510 CO 0.60 0.45 -0.12 0.00 -0.73 0.00 0.00 179.01 179.21 1ce8 h ALA 511 N 1.64 1.54 -0.77 2.92 0.00 -1.93 -2.14 119.26 120.53 1ce8 h ALA 511 Ca 0.14 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1ce8 h ALA 511 Cb 0.07 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 1ce8 h ALA 511 CO -0.02 0.15 0.40 0.93 0.00 0.00 0.00 179.25 180.71 1ce8 h GLU 512 N 0.00 1.08 -0.39 0.00 4.39 -1.61 -0.17 114.58 117.89 1ce8 h GLU 512 Ca -0.00 -0.14 -0.16 0.00 0.34 0.00 0.00 59.36 59.40 1ce8 h GLU 512 Cb 0.26 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.70 1ce8 h GLU 512 CO 0.02 0.82 -0.38 0.82 -1.16 0.00 0.00 179.01 179.12 1ce8 h ILE 513 N 1.07 1.27 -0.30 3.13 1.08 -1.39 -2.42 117.51 119.95 1ce8 h ILE 513 Ca 0.27 -1.56 -0.09 0.00 -0.39 0.00 0.00 64.86 63.09 1ce8 h ILE 513 Cb 0.07 1.37 -0.02 0.00 -3.07 0.00 0.00 36.82 35.18 1ce8 h ILE 513 CO -0.04 0.52 -0.19 -0.09 -0.69 0.00 0.00 178.15 177.66 1ce8 h ARG 514 N 0.76 0.55 -0.33 2.37 2.43 -1.10 -2.00 114.38 117.06 1ce8 h ARG 514 Ca 0.06 -0.19 -0.02 0.00 -0.81 0.00 0.00 59.98 59.03 1ce8 h ARG 514 Cb 0.97 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.47 1ce8 h ARG 514 CO 0.09 0.71 0.14 0.87 -1.51 0.00 0.00 179.97 180.28 1ce8 h LYS 515 N 0.49 0.49 -0.87 0.20 1.57 -0.94 -0.71 116.57 116.80 1ce8 h LYS 515 Ca 0.08 -0.08 0.10 0.00 -1.87 0.00 0.00 60.65 58.88 1ce8 h LYS 515 Cb 0.61 -0.08 -0.08 0.00 0.08 0.00 0.00 32.23 32.76 1ce8 h LYS 515 CO 0.04 0.47 0.51 1.25 -0.57 0.00 0.00 179.45 181.15 1ce8 h LEU 516 N 0.39 0.73 -1.03 2.94 5.85 -0.99 0.12 115.31 123.32 1ce8 h LEU 516 Ca 0.11 0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.79 1ce8 h LEU 516 Cb 0.16 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 1ce8 h LEU 516 CO -0.01 0.41 -0.45 0.03 -0.34 0.00 0.00 178.44 178.08 1ce8 h ARG 517 N 0.84 0.00 -0.05 1.25 3.08 -1.06 -0.88 114.38 117.56 1ce8 h ARG 517 Ca 0.43 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 60.27 1ce8 h ARG 517 Cb 0.41 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.45 1ce8 h ARG 517 CO -0.26 0.45 -0.82 -0.44 -1.07 0.00 0.00 179.97 177.83 1ce8 h ASP 518 N 0.00 0.52 -0.26 7.04 3.32 0.48 0.71 116.42 128.22 1ce8 h ASP 518 Ca -0.00 -0.37 -0.06 0.00 0.02 0.00 0.00 57.03 56.61 1ce8 h ASP 518 Cb 0.86 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.25 1ce8 h ASP 518 CO 0.06 1.14 -0.08 -0.61 -1.72 0.00 0.00 179.24 178.02 1ce8 h GLN 519 N 0.26 0.51 0.00 3.56 4.15 -0.48 -3.03 115.11 120.09 1ce8 h GLN 519 Ca -0.05 -0.21 0.00 0.00 0.77 0.00 0.00 58.65 59.16 1ce8 h GLN 519 Cb 1.42 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 29.09 1ce8 h GLN 519 CO 0.14 0.74 0.00 0.66 -1.93 0.00 0.00 178.83 178.44 1ce8 n TYR 520 N -4.52 0.00 -3.49 3.99 4.01 -0.37 -4.91 117.16 111.88 1ce8 n TYR 520 Ca -0.04 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.49 1ce8 n TYR 520 Cb 0.32 -0.47 0.07 0.00 -0.31 0.00 0.00 39.34 38.95 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 -1.47 -5.99 -4.35 7.72 2.03 0.44 -4.91 116.55 110.01 1ce8 n ASP 521 Ca 0.08 -0.49 -0.45 0.00 0.52 0.00 0.00 54.79 54.45 1ce8 n ASP 521 Cb 0.32 -4.62 -0.04 0.00 -0.72 0.00 0.00 41.12 36.07 1ce8 n ASP 521 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1ce8 s LEU 522 N -6.72 5.87 0.07 -2.67 2.96 0.22 -5.01 118.68 113.40 1ce8 s LEU 522 Ca 0.53 -1.84 0.02 0.00 -0.22 0.00 0.00 54.13 52.62 1ce8 s LEU 522 Cb -0.23 -2.27 -0.03 0.00 0.50 0.00 0.00 46.19 44.16 1ce8 s LEU 522 CO 0.66 -0.93 -0.08 -1.00 -1.32 0.00 0.00 176.35 173.68 1ce8 s HIS 523 N 1.87 0.81 0.74 5.38 3.76 -1.26 -4.67 115.29 121.92 1ce8 s HIS 523 Ca 0.12 -0.65 -0.11 0.00 -0.15 0.00 0.00 55.06 54.26 1ce8 s HIS 523 Cb -0.21 -0.47 0.04 0.00 1.11 0.00 0.00 32.58 33.04 1ce8 s HIS 523 CO 0.01 -0.09 1.10 -1.25 -0.85 0.00 0.00 174.74 173.66 1ce8 s PRO 524 N -2.47 2.55 0.39 8.40 0.04 -1.26 -4.83 135.00 137.82 1ce8 s PRO 524 Ca -0.01 0.51 0.08 0.00 0.04 0.00 0.00 61.00 61.62 1ce8 s PRO 524 Cb -0.04 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.46 1ce8 s PRO 524 CO -0.01 -1.27 0.13 0.14 0.04 0.00 0.00 177.00 176.03 1ce8 s VAL 525 N -3.30 2.38 -0.12 -0.36 -7.23 0.33 -4.88 120.40 107.22 1ce8 s VAL 525 Ca 0.59 -1.78 0.01 0.00 -1.81 0.00 0.00 61.98 58.99 1ce8 s VAL 525 Cb -0.12 -2.96 -0.01 0.00 0.56 0.00 0.00 36.38 33.84 1ce8 s VAL 525 CO 0.53 -0.05 -0.15 -0.31 -0.31 0.00 0.00 175.10 174.81 1ce8 s TYR 526 N -2.59 2.77 0.31 2.82 2.02 -1.26 -1.25 117.35 120.16 1ce8 s TYR 526 Ca 0.39 -0.66 0.07 0.00 -0.37 0.00 0.00 57.07 56.51 1ce8 s TYR 526 Cb 0.03 -1.81 -0.03 0.00 -0.40 0.00 0.00 41.96 39.76 1ce8 s TYR 526 CO 0.21 -0.21 0.24 0.15 -1.57 0.00 0.00 175.55 174.38 1ce8 s LYS 527 N 0.26 2.74 0.16 -0.62 -0.14 -0.57 0.31 119.74 121.88 1ce8 s LYS 527 Ca -0.10 -1.24 0.08 0.00 -1.36 0.00 0.00 55.97 53.35 1ce8 s LYS 527 Cb -0.16 -2.47 -0.04 0.00 -1.68 0.00 0.00 37.83 33.48 1ce8 s LYS 527 CO 0.06 0.20 -0.10 1.03 -0.76 0.00 0.00 175.35 175.78 1ce8 s ARG 528 N -3.92 2.08 0.15 1.68 0.52 -1.26 -2.08 118.95 116.11 1ce8 s ARG 528 Ca 0.38 -1.19 -0.23 0.00 -0.52 0.00 0.00 55.73 54.17 1ce8 s ARG 528 Cb -0.06 -2.20 -0.08 0.00 0.52 0.00 0.00 34.95 33.13 1ce8 s ARG 528 CO 0.25 0.46 0.71 0.08 0.02 0.00 0.00 175.30 176.82 1ce8 s VAL 529 N -1.54 4.50 0.00 3.52 1.01 0.66 -4.94 120.40 123.61 1ce8 s VAL 529 Ca 0.24 1.50 0.00 0.00 0.00 0.00 0.00 61.98 63.72 1ce8 s VAL 529 Cb -0.10 -4.03 0.00 0.00 0.00 0.00 0.00 36.38 32.25 1ce8 s VAL 529 CO 0.15 0.49 0.00 -0.90 0.00 0.00 0.00 175.10 174.84 1ce8 n ASP 530 N 1.52 0.00 0.00 3.32 5.68 -1.26 -4.77 116.55 121.04 1ce8 n ASP 530 Ca -0.07 -0.67 0.00 0.00 -0.50 0.00 0.00 54.79 53.55 1ce8 n ASP 530 Cb 0.50 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.48 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 -2.14 2.12 -2.24 -1.06 -4.49 114.28 106.48 1ce8 n THR 531 Ca 0.00 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.82 1ce8 n THR 531 Cb 0.17 0.00 0.10 0.00 -2.10 0.00 0.00 70.33 68.50 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 -0.23 -0.89 -1.03 0.00 0.00 0.57 -0.64 120.51 118.29 1ce8 n ALA 533 Ca 0.12 0.07 -0.01 0.00 0.00 0.00 0.00 53.44 53.62 1ce8 n ALA 533 Cb 0.95 -1.53 -0.00 0.00 0.00 0.00 0.00 19.45 18.86 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 -2.58 -0.01 0.25 0.00 0.00 -1.26 -4.90 120.51 112.01 1ce8 n ALA 534 Ca -0.08 0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.49 1ce8 n ALA 534 Cb 0.57 -0.43 0.62 0.00 0.00 0.00 0.00 19.45 20.21 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 0.63 0.00 -5.02 0.00 4.81 -1.29 -3.43 114.58 110.29 1ce8 h GLU 535 Ca -0.02 0.00 -0.39 0.00 -0.13 0.00 0.00 59.36 58.83 1ce8 h GLU 535 Cb 0.23 0.00 -0.24 0.00 0.63 0.00 0.00 28.75 29.37 1ce8 h GLU 535 CO 0.03 0.17 -0.77 -0.06 -0.73 0.00 0.00 179.01 177.64 1ce8 s PHE 536 N -4.01 1.00 0.87 0.92 0.08 -1.26 -5.15 117.98 110.43 1ce8 s PHE 536 Ca -0.02 -0.37 -0.11 0.00 0.12 0.00 0.00 56.93 56.56 1ce8 s PHE 536 Cb 0.12 -0.59 0.11 0.00 -0.57 0.00 0.00 43.02 42.09 1ce8 s PHE 536 CO 0.61 0.00 1.10 0.00 -0.10 0.00 0.00 175.22 176.83 1ce8 s ALA 537 N -0.93 1.70 0.08 5.36 0.00 -1.26 -4.95 121.76 121.76 1ce8 s ALA 537 Ca -0.02 0.18 0.05 0.00 0.00 0.00 0.00 51.96 52.17 1ce8 s ALA 537 Cb -0.08 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.74 1ce8 s ALA 537 CO 0.01 -2.28 -0.13 -0.08 0.00 0.00 0.00 175.76 173.28 1ce8 s THR 538 N -2.85 1.08 -0.26 0.00 -1.32 -1.26 -4.38 115.64 106.65 1ce8 s THR 538 Ca 0.63 -1.38 0.02 0.00 -1.21 0.00 0.00 61.69 59.76 1ce8 s THR 538 Cb -0.19 -1.13 0.05 0.00 -1.51 0.00 0.00 72.50 69.72 1ce8 s THR 538 CO 0.57 -0.30 0.83 0.47 -2.21 0.00 0.00 174.62 173.98 1ce8 n ASP 539 N 1.11 1.73 -4.91 8.08 8.00 -1.25 -4.97 116.55 124.34 1ce8 n ASP 539 Ca -0.20 -1.57 -0.31 0.00 0.71 0.00 0.00 54.79 53.41 1ce8 n ASP 539 Cb 0.55 -0.03 -0.04 0.00 -0.02 0.00 0.00 41.12 41.58 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 -0.62 5.26 -0.71 -3.53 2.01 -1.26 -5.06 115.64 111.73 1ce8 s THR 540 Ca 0.04 -0.13 0.04 0.00 0.31 0.00 0.00 61.69 61.95 1ce8 s THR 540 Cb 0.02 -3.62 0.25 0.00 0.01 0.00 0.00 72.50 69.16 1ce8 s THR 540 CO 0.03 0.09 0.83 0.00 -0.69 0.00 0.00 174.62 174.88 1ce8 n ALA 541 N 0.21 4.16 -3.55 7.40 0.00 -1.26 -4.94 120.51 122.53 1ce8 n ALA 541 Ca -0.04 -4.76 -0.39 0.00 0.00 0.00 0.00 53.44 48.26 1ce8 n ALA 541 Cb 0.51 -1.13 -0.10 0.00 0.00 0.00 0.00 19.45 18.73 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 -2.41 3.44 0.26 0.00 5.04 -1.26 -0.56 117.35 121.86 1ce8 s TYR 542 Ca 0.37 -1.94 0.07 0.00 -2.44 0.00 0.00 57.07 53.13 1ce8 s TYR 542 Cb 0.11 -3.17 -0.05 0.00 0.35 0.00 0.00 41.96 39.20 1ce8 s TYR 542 CO -0.01 -0.93 -0.10 -1.64 -1.34 0.00 0.00 175.55 171.52 1ce8 s MET 543 N 1.30 1.49 0.06 4.97 -1.94 0.91 -0.25 119.30 125.85 1ce8 s MET 543 Ca 0.05 -1.72 0.03 0.00 -1.71 0.00 0.00 55.69 52.34 1ce8 s MET 543 Cb -0.24 -1.21 -0.03 0.00 2.01 0.00 0.00 34.83 35.37 1ce8 s MET 543 CO -0.01 0.11 -0.08 1.52 -0.01 0.00 0.00 175.02 176.55 1ce8 s TYR 544 N -2.95 0.81 0.27 -0.03 1.13 -0.88 -1.39 117.35 114.31 1ce8 s TYR 544 Ca 0.27 -0.59 -0.10 0.00 -1.41 0.00 0.00 57.07 55.24 1ce8 s TYR 544 Cb 0.01 -0.47 -0.07 0.00 -1.10 0.00 0.00 41.96 40.33 1ce8 s TYR 544 CO 0.11 -0.07 0.61 -1.54 -2.51 0.00 0.00 175.55 172.14 1ce8 s SER 545 N -1.96 6.64 0.17 -0.18 1.04 -1.26 -1.51 113.70 116.64 1ce8 s SER 545 Ca -0.04 1.00 -0.24 0.00 0.48 0.00 0.00 55.95 57.16 1ce8 s SER 545 Cb -0.06 -2.26 0.06 0.00 0.10 0.00 0.00 66.02 63.86 1ce8 s SER 545 CO -0.00 -0.14 0.74 0.28 0.98 0.00 0.00 173.24 175.10 1ce8 s THR 546 N -1.92 0.00 -1.04 2.02 -1.32 -0.38 -4.75 115.64 108.25 1ce8 s THR 546 Ca 0.49 -0.41 -0.05 0.00 -1.21 0.00 0.00 61.69 60.50 1ce8 s THR 546 Cb -0.11 -1.46 0.27 0.00 -1.51 0.00 0.00 72.50 69.69 1ce8 s THR 546 CO 0.22 0.00 1.13 -1.22 -2.21 0.00 0.00 174.62 172.54 1ce8 n TYR 547 N -0.40 4.20 -3.74 9.09 4.02 -1.26 0.12 117.16 129.20 1ce8 n TYR 547 Ca -0.10 -3.62 0.00 0.00 -0.01 0.00 0.00 57.90 54.17 1ce8 n TYR 547 Cb 0.62 -1.42 0.00 0.00 -0.02 0.00 0.00 39.34 38.52 1ce8 n TYR 547 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 1ce8 n GLU 548 N 2.15 0.99 -0.03 -0.72 2.13 -1.26 -4.84 120.64 119.06 1ce8 n GLU 548 Ca 0.24 0.00 -0.00 0.00 0.66 0.00 0.00 57.16 58.06 1ce8 n GLU 548 Cb 0.37 0.00 -0.00 0.00 0.27 0.00 0.00 31.44 32.08 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 -6.16 5.31 4.39 -1.98 -3.42 114.58 112.71 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 0.09 -2.00 -1.16 0.00 0.00 179.01 175.94 1ce8 s GLU 550 N -1.32 4.43 -0.06 2.33 2.12 -1.26 -4.97 118.70 119.96 1ce8 s GLU 550 Ca -0.01 0.92 -0.10 0.00 0.36 0.00 0.00 54.97 56.14 1ce8 s GLU 550 Cb 0.00 -3.38 -0.05 0.00 0.26 0.00 0.00 34.13 30.97 1ce8 s GLU 550 CO 0.01 0.25 0.25 0.00 -0.54 0.00 0.00 175.26 175.24 1ce8 n GLU 552 N 1.81 2.64 0.16 0.00 1.02 0.15 -4.75 120.64 121.68 1ce8 n GLU 552 Ca -0.17 -1.75 -0.14 0.00 -0.02 0.00 0.00 57.16 55.08 1ce8 n GLU 552 Cb 0.54 -1.16 -0.07 0.00 -0.02 0.00 0.00 31.44 30.73 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 1.27 -0.59 -6.50 0.62 0.00 -1.94 -3.47 119.26 108.65 1ce8 h ALA 553 Ca 0.00 -0.08 -0.50 0.00 0.00 0.00 0.00 54.91 54.34 1ce8 h ALA 553 Cb 0.61 0.46 0.01 0.00 0.00 0.00 0.00 17.79 18.87 1ce8 h ALA 553 CO 0.00 -0.87 -0.95 0.09 0.00 0.00 0.00 179.25 177.52 1ce8 n ASN 554 N -5.41 -3.41 -4.61 0.00 5.03 -1.26 -4.86 115.26 100.73 1ce8 n ASN 554 Ca -0.08 -1.09 -0.35 0.00 0.87 0.00 0.00 54.58 53.93 1ce8 n ASN 554 Cb 0.32 -2.82 0.10 0.00 -1.02 0.00 0.00 39.78 36.36 1ce8 n ASN 554 CO 0.00 0.00 0.00 -2.65 -1.83 0.00 0.00 177.26 172.78 1ce8 n PRO 555 N -4.46 0.41 -3.48 3.52 -0.02 -1.26 -4.97 135.00 124.73 1ce8 n PRO 555 Ca -0.17 0.20 -0.38 0.00 -2.02 0.00 0.00 63.50 61.13 1ce8 n PRO 555 Cb 0.62 -2.23 -0.06 0.00 -0.02 0.00 0.00 33.50 31.81 1ce8 n PRO 555 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1ce8 s SER 556 N -1.73 6.83 0.00 2.55 1.04 -1.26 -4.97 113.70 116.16 1ce8 s SER 556 Ca 0.72 0.99 0.13 0.00 0.48 0.00 0.00 55.95 58.28 1ce8 s SER 556 Cb -0.33 -2.26 0.02 0.00 0.10 0.00 0.00 66.02 63.55 1ce8 s SER 556 CO 0.51 0.32 0.80 0.35 0.98 0.00 0.00 173.24 176.20 1ce8 n THR 557 N 1.79 0.00 0.08 2.02 -2.24 -1.26 -4.54 114.28 110.12 1ce8 n THR 557 Ca -0.14 -0.40 -0.14 0.00 -2.27 0.00 0.00 64.05 61.11 1ce8 n THR 557 Cb 0.52 1.19 -0.06 0.00 -2.10 0.00 0.00 70.33 69.88 1ce8 n THR 557 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 1ce8 h ASP 558 N 1.79 0.50 -1.88 3.42 3.58 -2.02 -3.48 116.42 118.32 1ce8 h ASP 558 Ca 0.00 -0.43 -0.60 0.00 0.42 0.00 0.00 57.03 56.43 1ce8 h ASP 558 Cb 0.48 -0.16 -0.13 0.00 1.72 0.00 0.00 39.33 41.25 1ce8 h ASP 558 CO 0.00 1.24 -0.58 -0.13 -2.88 0.00 0.00 179.24 176.89 1ce8 s ARG 559 N -3.15 1.93 -0.45 0.28 0.52 -1.26 -5.10 118.95 111.73 1ce8 s ARG 559 Ca -0.05 -2.13 -0.21 0.00 -0.52 0.00 0.00 55.73 52.82 1ce8 s ARG 559 Cb 0.08 -1.36 0.03 0.00 0.52 0.00 0.00 34.95 34.22 1ce8 s ARG 559 CO 0.87 -0.18 0.68 -1.21 0.02 0.00 0.00 175.30 175.48 1ce8 s GLU 560 N -3.79 3.29 0.06 3.54 2.02 -1.26 -4.96 118.70 117.59 1ce8 s GLU 560 Ca 0.29 -0.37 -0.09 0.00 0.02 0.00 0.00 54.97 54.82 1ce8 s GLU 560 Cb 0.07 -3.97 -0.05 0.00 0.10 0.00 0.00 34.13 30.28 1ce8 s GLU 560 CO 0.14 -1.07 0.35 0.15 0.02 0.00 0.00 175.26 174.85 1ce8 s LYS 561 N 2.94 3.69 -0.11 1.61 1.02 -1.26 -1.61 119.74 126.01 1ce8 s LYS 561 Ca 0.23 0.08 0.02 0.00 0.02 0.00 0.00 55.97 56.32 1ce8 s LYS 561 Cb -0.14 -3.02 0.02 0.00 -0.52 0.00 0.00 37.83 34.16 1ce8 s LYS 561 CO 0.19 0.59 -0.15 0.42 -0.92 0.00 0.00 175.35 175.48 1ce8 s ILE 562 N -1.37 1.52 -0.07 2.17 -1.09 -0.16 -1.15 121.20 121.05 1ce8 s ILE 562 Ca 0.31 -0.65 -0.04 0.00 -2.23 0.00 0.00 60.65 58.04 1ce8 s ILE 562 Cb -0.14 -1.39 -0.04 0.00 -1.58 0.00 0.00 42.46 39.31 1ce8 s ILE 562 CO 0.18 0.45 0.11 -0.04 -1.23 0.00 0.00 174.94 174.40 1ce8 s MET 563 N 1.02 3.28 -0.13 2.79 -1.94 -0.01 -1.19 119.30 123.13 1ce8 s MET 563 Ca -0.06 -0.28 0.02 0.00 -1.71 0.00 0.00 55.69 53.67 1ce8 s MET 563 Cb -0.15 -3.04 0.01 0.00 2.01 0.00 0.00 34.83 33.67 1ce8 s MET 563 CO -0.02 0.72 -0.18 0.08 -0.01 0.00 0.00 175.02 175.61 1ce8 s VAL 564 N -1.08 1.79 -0.27 -6.03 1.01 -0.31 -0.01 120.40 115.49 1ce8 s VAL 564 Ca 0.18 -0.81 -0.10 0.00 0.00 0.00 0.00 61.98 61.25 1ce8 s VAL 564 Cb -0.12 -1.61 -0.05 0.00 0.00 0.00 0.00 36.38 34.61 1ce8 s VAL 564 CO 0.08 0.50 0.17 -0.76 0.00 0.00 0.00 175.10 175.09 1ce8 s LEU 565 N 0.96 3.96 0.00 3.92 1.43 -0.84 -1.13 118.68 126.99 1ce8 s LEU 565 Ca -0.05 -0.02 -0.07 0.00 -1.03 0.00 0.00 54.13 52.96 1ce8 s LEU 565 Cb -0.15 -2.09 0.10 0.00 0.03 0.00 0.00 46.19 44.08 1ce8 s LEU 565 CO -0.03 -0.03 0.39 0.61 0.23 0.00 0.00 176.35 177.52 1ce8 n GLY 566 N 4.94 -2.32 0.44 -3.19 0.00 0.93 -3.44 105.19 102.56 1ce8 n GLY 566 Ca -0.14 -1.50 0.04 0.00 0.00 0.00 0.00 46.02 44.42 1ce8 n GLY 566 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ce8 n GLY 567 N 0.37 1.61 7.00 -0.02 0.00 -1.23 -4.30 105.19 108.62 1ce8 n GLY 567 Ca 0.05 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 0.36 -0.07 3.75 -0.02 0.00 -1.26 -4.69 105.19 103.25 1ce8 n GLY 568 Ca 0.08 -1.03 -0.35 0.00 0.00 0.00 0.00 46.02 44.71 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 2.81 0.52 1.61 0.04 -1.26 -4.28 135.00 134.45 1ce8 s PRO 569 Ca 0.00 1.79 -0.16 0.00 0.04 0.00 0.00 61.00 62.67 1ce8 s PRO 569 Cb 0.00 -1.91 -0.07 0.00 0.04 0.00 0.00 34.50 32.55 1ce8 s PRO 569 CO 0.00 -1.32 0.99 -0.80 0.04 0.00 0.00 177.00 175.91 1ce8 s ASN 570 N -1.73 6.55 0.25 6.66 0.02 -1.26 -4.88 114.94 120.55 1ce8 s ASN 570 Ca 0.76 1.58 -0.12 0.00 -1.02 0.00 0.00 52.86 54.06 1ce8 s ASN 570 Cb -0.30 -2.51 -0.00 0.00 0.02 0.00 0.00 41.25 38.46 1ce8 s ASN 570 CO 0.36 -0.64 0.47 -0.13 0.02 0.00 0.00 177.10 177.18 1ce8 s ARG 571 N -4.12 1.55 0.04 -0.60 3.00 -1.06 -3.78 118.95 113.98 1ce8 s ARG 571 Ca 0.59 -1.28 -0.30 0.00 0.00 0.00 0.00 55.73 54.74 1ce8 s ARG 571 Cb -0.10 0.47 -0.08 0.00 0.00 0.00 0.00 34.95 35.23 1ce8 s ARG 571 CO 0.33 -0.64 1.72 0.42 0.00 0.00 0.00 175.30 177.12 1ce8 s ILE 572 N -3.98 3.14 0.00 1.52 1.01 -1.26 -1.00 121.20 120.64 1ce8 s ILE 572 Ca 0.23 0.44 0.00 0.00 0.00 0.00 0.00 60.65 61.32 1ce8 s ILE 572 Cb -0.00 -3.28 0.00 0.00 0.01 0.00 0.00 42.46 39.18 1ce8 s ILE 572 CO 0.09 -0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.63 1ce8 n GLY 573 N 4.13 3.29 2.51 6.18 0.00 -1.26 -4.90 105.19 115.13 1ce8 n GLY 573 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.30 2.22 0.00 1.61 1.13 -0.17 -4.99 117.38 115.89 1ce8 n GLN 574 Ca 0.00 -4.30 0.00 0.00 -1.94 0.00 0.00 57.00 50.76 1ce8 n GLN 574 Cb 0.00 -1.99 0.00 0.00 0.11 0.00 0.00 30.24 28.36 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 0.53 0.72 0.28 1.08 0.00 -1.21 -2.56 105.19 104.02 1ce8 n GLY 575 Ca 0.28 -1.82 0.10 0.00 0.00 0.00 0.00 46.02 44.58 1ce8 n GLY 575 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1ce8 h ILE 576 N 0.00 0.96 -0.83 -0.61 2.10 -1.92 -2.73 117.51 114.48 1ce8 h ILE 576 Ca 0.00 -0.00 0.16 0.00 1.08 0.00 0.00 64.86 66.10 1ce8 h ILE 576 Cb 0.00 0.95 -0.06 0.00 -1.09 0.00 0.00 36.82 36.62 1ce8 h ILE 576 CO 0.00 0.00 0.55 -0.33 -1.08 0.00 0.00 178.15 177.29 1ce8 h GLU 577 N 0.01 0.47 0.03 2.19 3.07 -1.89 0.16 114.58 118.63 1ce8 h GLU 577 Ca 0.04 -0.03 -0.21 0.00 -0.50 0.00 0.00 59.36 58.66 1ce8 h GLU 577 Cb 0.15 -0.11 0.02 0.00 -0.84 0.00 0.00 28.75 27.97 1ce8 h GLU 577 CO -0.00 0.31 -0.86 0.74 -1.40 0.00 0.00 179.01 177.80 1ce8 h PHE 578 N 0.49 0.80 -0.37 4.33 0.04 -1.75 -2.79 116.94 117.68 1ce8 h PHE 578 Ca 0.42 -0.46 0.02 0.00 2.80 0.00 0.00 57.97 60.75 1ce8 h PHE 578 Cb 0.90 -0.08 -0.03 0.00 2.20 0.00 0.00 35.95 38.94 1ce8 h PHE 578 CO -0.00 1.30 0.20 0.22 -0.60 0.00 0.00 178.31 179.42 1ce8 h ASP 579 N 0.07 0.30 -0.57 2.17 3.58 -1.31 -0.59 116.42 120.08 1ce8 h ASP 579 Ca -0.12 0.01 0.11 0.00 0.42 0.00 0.00 57.03 57.45 1ce8 h ASP 579 Cb 1.56 -0.05 -0.11 0.00 1.72 0.00 0.00 39.33 42.45 1ce8 h ASP 579 CO 0.17 0.22 -0.29 0.22 -2.88 0.00 0.00 179.24 176.68 1ce8 h TYR 580 N 0.40 -0.78 -0.43 0.28 5.03 -0.78 0.72 116.97 121.41 1ce8 h TYR 580 Ca 0.15 0.07 0.05 0.00 2.58 0.00 0.00 58.73 61.57 1ce8 h TYR 580 Cb 0.04 0.43 -0.04 0.00 1.55 0.00 0.00 36.73 38.70 1ce8 h TYR 580 CO -0.09 -0.36 0.17 0.00 -1.32 0.00 0.00 178.16 176.56 1ce8 h VAL 583 N 0.03 0.37 -0.75 0.00 2.07 0.72 -2.49 116.25 116.20 1ce8 h VAL 583 Ca 0.08 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.74 1ce8 h VAL 583 Cb 0.11 0.37 -0.10 0.00 -1.52 0.00 0.00 31.29 30.15 1ce8 h VAL 583 CO -0.15 0.00 0.28 0.45 0.02 0.00 0.00 177.57 178.17 1ce8 h HIS 584 N -0.29 0.47 -0.42 1.57 3.86 -0.81 -1.15 115.15 118.38 1ce8 h HIS 584 Ca 0.12 0.04 0.03 0.00 -1.16 0.00 0.00 60.37 59.40 1ce8 h HIS 584 Cb 0.48 -0.09 -0.04 0.00 1.06 0.00 0.00 27.41 28.82 1ce8 h HIS 584 CO -0.39 0.04 0.20 0.00 0.86 0.00 0.00 177.93 178.64 1ce8 h ALA 585 N 1.55 0.52 0.32 2.45 0.00 -1.01 0.14 119.26 123.23 1ce8 h ALA 585 Ca 0.41 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.33 1ce8 h ALA 585 Cb 0.64 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1ce8 h ALA 585 CO -0.42 -0.16 -0.15 1.03 0.00 0.00 0.00 179.25 179.55 1ce8 h SER 586 N 0.41 -0.37 -0.66 0.00 0.87 -0.91 -0.23 113.55 112.66 1ce8 h SER 586 Ca 0.18 -0.02 0.07 0.00 -1.23 0.00 0.00 61.79 60.79 1ce8 h SER 586 Cb 0.09 0.09 -0.06 0.00 -0.44 0.00 0.00 62.40 62.09 1ce8 h SER 586 CO -0.13 -0.22 0.35 -0.07 -0.53 0.00 0.00 176.83 176.23 1ce8 h LEU 587 N -0.48 0.50 0.86 2.23 3.38 -1.03 0.02 115.31 120.77 1ce8 h LEU 587 Ca -0.04 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1ce8 h LEU 587 Cb 0.37 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 41.07 1ce8 h LEU 587 CO 0.07 0.31 -0.41 0.00 0.09 0.00 0.00 178.44 178.50 1ce8 h ALA 588 N 1.37 -1.23 0.00 1.53 0.00 -0.46 -1.45 119.26 119.01 1ce8 h ALA 588 Ca 0.31 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1ce8 h ALA 588 Cb 0.24 0.45 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1ce8 h ALA 588 CO -0.21 -1.15 -0.09 -0.07 0.00 0.00 0.00 179.25 177.73 1ce8 h LEU 589 N -1.22 0.00 0.03 0.00 3.38 -1.01 -1.24 115.31 115.24 1ce8 h LEU 589 Ca -0.12 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1ce8 h LEU 589 Cb 0.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.63 1ce8 h LEU 589 CO 0.19 0.09 -0.01 -0.09 0.09 0.00 0.00 178.44 178.71 1ce8 h ARG 590 N 0.00 -0.03 -0.81 1.13 2.43 -0.94 0.18 114.38 116.33 1ce8 h ARG 590 Ca -0.00 0.00 0.11 0.00 -0.81 0.00 0.00 59.98 59.28 1ce8 h ARG 590 Cb 0.38 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.86 1ce8 h ARG 590 CO 0.01 0.54 0.44 1.49 -1.51 0.00 0.00 179.97 180.94 1ce8 h GLU 591 N -0.64 0.68 0.00 0.20 4.57 -0.98 0.24 114.58 118.65 1ce8 h GLU 591 Ca -0.00 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 1ce8 h GLU 591 Cb 0.59 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.03 1ce8 h GLU 591 CO 0.01 0.45 0.00 -0.25 -1.18 0.00 0.00 179.01 178.04 1ce8 n ASP 592 N -4.80 0.00 0.00 1.04 9.92 -0.49 -4.86 116.55 117.35 1ce8 n ASP 592 Ca 0.14 0.28 0.00 0.00 -0.53 0.00 0.00 54.79 54.68 1ce8 n ASP 592 Cb 0.32 -0.39 0.00 0.00 -0.64 0.00 0.00 41.12 40.41 1ce8 n ASP 592 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ce8 n GLY 593 N -0.05 1.36 3.82 0.44 0.00 0.84 -5.06 105.19 106.54 1ce8 n GLY 593 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.05 3.21 -0.28 1.61 2.02 0.60 -4.84 117.35 117.63 1ce8 s TYR 594 Ca 0.00 1.46 -0.20 0.00 -0.37 0.00 0.00 57.07 57.97 1ce8 s TYR 594 Cb 0.00 -2.89 -0.02 0.00 -0.40 0.00 0.00 41.96 38.65 1ce8 s TYR 594 CO 0.00 -0.85 0.59 -2.00 -1.57 0.00 0.00 175.55 171.72 1ce8 s GLU 595 N -4.31 4.01 -0.20 -0.62 2.12 -0.63 -4.26 118.70 114.81 1ce8 s GLU 595 Ca 0.61 0.37 -0.09 0.00 0.36 0.00 0.00 54.97 56.22 1ce8 s GLU 595 Cb -0.13 -3.68 -0.05 0.00 0.26 0.00 0.00 34.13 30.53 1ce8 s GLU 595 CO 0.39 -0.46 0.12 0.95 -0.54 0.00 0.00 175.26 175.72 1ce8 s THR 596 N 2.48 5.22 -0.20 -1.70 -4.23 -1.26 -0.99 115.64 114.97 1ce8 s THR 596 Ca 0.24 0.12 -0.02 0.00 -1.18 0.00 0.00 61.69 60.86 1ce8 s THR 596 Cb -0.15 -3.38 0.00 0.00 1.34 0.00 0.00 72.50 70.31 1ce8 s THR 596 CO 0.10 0.43 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.87 1ce8 s ILE 597 N 0.49 2.82 -0.10 2.99 1.01 -0.34 0.11 121.20 128.19 1ce8 s ILE 597 Ca 0.07 -0.69 -0.02 0.00 0.00 0.00 0.00 60.65 60.01 1ce8 s ILE 597 Cb -0.12 -2.24 -0.03 0.00 0.01 0.00 0.00 42.46 40.07 1ce8 s ILE 597 CO -0.00 0.48 -0.00 -0.32 0.00 0.00 0.00 174.94 175.09 1ce8 s MET 598 N 1.31 3.08 -0.23 2.79 -2.45 0.56 -1.16 119.30 123.20 1ce8 s MET 598 Ca 0.04 -0.42 0.02 0.00 -1.25 0.00 0.00 55.69 54.08 1ce8 s MET 598 Cb -0.14 -2.82 0.05 0.00 1.25 0.00 0.00 34.83 33.17 1ce8 s MET 598 CO -0.06 0.64 -0.10 0.08 1.05 0.00 0.00 175.02 176.63 1ce8 s VAL 599 N -0.71 1.84 0.02 10.11 1.01 -0.28 -1.23 120.40 131.15 1ce8 s VAL 599 Ca 0.11 -1.27 -0.29 0.00 0.00 0.00 0.00 61.98 60.54 1ce8 s VAL 599 Cb -0.12 -1.94 0.10 0.00 0.00 0.00 0.00 36.38 34.42 1ce8 s VAL 599 CO 0.02 0.07 0.99 0.21 0.00 0.00 0.00 175.10 176.39 1ce8 s ASN 600 N 1.28 -0.25 -0.00 3.32 2.47 -1.10 -0.05 114.94 120.62 1ce8 s ASN 600 Ca -0.04 -0.14 0.25 0.00 0.42 0.00 0.00 52.86 53.35 1ce8 s ASN 600 Cb -0.18 0.36 0.42 0.00 -1.45 0.00 0.00 41.25 40.41 1ce8 s ASN 600 CO -0.07 -0.63 1.17 0.00 -3.72 0.00 0.00 177.10 173.85 1ce8 s ASN 602 N -1.99 6.15 0.25 0.00 3.84 -1.26 -1.61 114.94 120.33 1ce8 s ASN 602 Ca 0.33 -0.24 0.25 0.00 0.21 0.00 0.00 52.86 53.41 1ce8 s ASN 602 Cb 0.38 -2.18 0.94 0.00 -0.55 0.00 0.00 41.25 39.84 1ce8 s ASN 602 CO -0.17 -0.30 1.74 -0.81 -2.79 0.00 0.00 177.10 174.77 1ce8 n PRO 603 N 5.32 0.22 0.19 0.43 -0.04 -1.26 -3.34 135.00 136.52 1ce8 n PRO 603 Ca -0.10 0.37 0.10 0.00 -0.04 0.00 0.00 63.50 63.83 1ce8 n PRO 603 Cb 0.50 -1.86 0.12 0.00 -0.04 0.00 0.00 33.50 32.21 1ce8 n PRO 603 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1ce8 h GLU 604 N 0.00 0.00 -7.03 0.54 5.08 -1.90 -3.41 114.58 107.86 1ce8 h GLU 604 Ca 0.00 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.87 1ce8 h GLU 604 Cb 0.48 0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.78 1ce8 h GLU 604 CO 0.00 0.09 0.15 0.95 -1.00 0.00 0.00 179.01 179.20 1ce8 s THR 605 N -3.18 4.46 0.15 1.13 -4.23 -1.21 -2.93 115.64 109.83 1ce8 s THR 605 Ca 0.05 0.18 0.17 0.00 -1.18 0.00 0.00 61.69 60.91 1ce8 s THR 605 Cb 0.06 -3.72 0.09 0.00 1.34 0.00 0.00 72.50 70.27 1ce8 s THR 605 CO 0.70 -0.74 1.67 0.58 -0.54 0.00 0.00 174.62 176.29 1ce8 h VAL 606 N 0.05 0.99 0.00 2.29 2.07 -1.91 -3.11 116.25 116.63 1ce8 h VAL 606 Ca -0.46 -1.74 -0.04 0.00 0.82 0.00 0.00 66.70 65.28 1ce8 h VAL 606 Cb 1.22 2.04 -0.01 0.00 -1.52 0.00 0.00 31.29 33.03 1ce8 h VAL 606 CO 0.61 0.43 -0.17 0.77 0.02 0.00 0.00 177.57 179.23 1ce8 h SER 607 N 0.00 0.00 -0.47 0.57 4.64 -1.92 -1.95 113.55 114.41 1ce8 h SER 607 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ce8 h SER 607 Cb 1.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 1ce8 h SER 607 CO 0.06 0.17 0.00 0.35 -0.87 0.00 0.00 176.83 176.54 1ce8 n THR 608 N -3.74 1.16 -3.13 2.95 -2.24 -1.17 -4.81 114.28 103.29 1ce8 n THR 608 Ca -0.02 -0.80 -0.40 0.00 -2.27 0.00 0.00 64.05 60.57 1ce8 n THR 608 Cb 0.29 0.08 -0.06 0.00 -2.10 0.00 0.00 70.33 68.54 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 -0.82 6.74 0.47 3.42 -1.08 -0.74 -4.95 116.67 119.71 1ce8 s ASP 609 Ca 0.36 0.90 0.23 0.00 -0.52 0.00 0.00 52.55 53.51 1ce8 s ASP 609 Cb 0.22 -2.35 1.24 0.00 -1.46 0.00 0.00 42.92 40.57 1ce8 s ASP 609 CO 0.19 -0.20 1.88 0.10 0.52 0.00 0.00 175.17 177.66 1ce8 h TYR 610 N 7.23 0.31 0.00 -5.34 -0.00 -1.87 -0.91 116.97 116.39 1ce8 h TYR 610 Ca -0.35 0.01 0.00 0.00 0.00 0.00 0.00 58.73 58.39 1ce8 h TYR 610 Cb 1.16 -0.09 0.00 0.00 0.00 0.00 0.00 36.73 37.79 1ce8 h TYR 610 CO 0.69 0.08 0.00 -0.25 -0.00 0.00 0.00 178.16 178.68 1ce8 n ASP 611 N -4.42 0.58 0.20 0.10 8.00 -1.26 -3.13 116.55 116.63 1ce8 n ASP 611 Ca 0.18 0.66 0.10 0.00 0.71 0.00 0.00 54.79 56.44 1ce8 n ASP 611 Cb 0.77 -0.78 0.24 0.00 -0.02 0.00 0.00 41.12 41.33 1ce8 n ASP 611 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1ce8 h THR 612 N 0.00 0.33 -4.59 -3.53 2.02 -1.41 -3.47 112.91 102.27 1ce8 h THR 612 Ca 0.00 -1.30 -0.25 0.00 0.77 0.00 0.00 66.41 65.63 1ce8 h THR 612 Cb 0.29 2.02 -0.15 0.00 -1.74 0.00 0.00 68.15 68.58 1ce8 h THR 612 CO 0.00 0.17 -0.60 -0.94 0.37 0.00 0.00 175.52 174.52 1ce8 s SER 613 N -6.21 0.25 0.01 4.18 1.04 -1.18 -4.34 113.70 107.44 1ce8 s SER 613 Ca 0.04 -1.41 -0.22 0.00 0.48 0.00 0.00 55.95 54.85 1ce8 s SER 613 Cb 0.07 0.40 -0.18 0.00 0.10 0.00 0.00 66.02 66.41 1ce8 s SER 613 CO 0.67 -0.86 1.24 0.44 0.98 0.00 0.00 173.24 175.71 1ce8 h ASP 614 N 2.58 0.30 -3.42 7.02 3.32 -0.79 -3.44 116.42 122.00 1ce8 h ASP 614 Ca -0.35 -0.57 -0.50 0.00 0.02 0.00 0.00 57.03 55.63 1ce8 h ASP 614 Cb 1.25 -0.09 -0.34 0.00 0.22 0.00 0.00 39.33 40.37 1ce8 h ASP 614 CO 0.51 0.82 -0.81 -0.13 -1.72 0.00 0.00 179.24 177.92 1ce8 s ARG 615 N -3.94 1.56 -0.18 3.56 0.52 0.12 -4.45 118.95 116.14 1ce8 s ARG 615 Ca -0.15 -0.36 -0.00 0.00 -0.52 0.00 0.00 55.73 54.70 1ce8 s ARG 615 Cb 0.04 -1.32 0.01 0.00 0.52 0.00 0.00 34.95 34.19 1ce8 s ARG 615 CO 0.74 0.00 -0.15 -1.17 0.02 0.00 0.00 175.30 174.74 1ce8 s LEU 616 N 0.73 2.39 -0.40 2.53 2.96 0.28 -0.32 118.68 126.86 1ce8 s LEU 616 Ca -0.13 -0.55 -0.05 0.00 -0.22 0.00 0.00 54.13 53.18 1ce8 s LEU 616 Cb -0.15 -1.56 0.09 0.00 0.50 0.00 0.00 46.19 45.06 1ce8 s LEU 616 CO 0.03 0.01 0.19 -0.31 -1.32 0.00 0.00 176.35 174.95 1ce8 s TYR 617 N 1.23 3.44 -1.30 5.38 1.51 -0.37 -0.06 117.35 127.18 1ce8 s TYR 617 Ca 0.03 -2.00 -0.18 0.00 -1.01 0.00 0.00 57.07 53.91 1ce8 s TYR 617 Cb -0.14 -2.95 0.04 0.00 -0.11 0.00 0.00 41.96 38.80 1ce8 s TYR 617 CO -0.08 -0.90 1.85 0.34 -1.11 0.00 0.00 175.55 175.65 1ce8 n PHE 618 N 4.72 4.18 -4.42 2.71 -0.00 -0.48 -2.69 117.46 121.48 1ce8 n PHE 618 Ca -0.07 -2.68 -0.21 0.00 -0.00 0.00 0.00 57.45 54.49 1ce8 n PHE 618 Cb 0.42 -2.60 -0.10 0.00 -0.00 0.00 0.00 39.48 37.20 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 4.32 1.55 0.22 -4.13 0.41 -1.08 -4.64 118.70 115.34 1ce8 s GLU 619 Ca 0.54 -1.81 -0.30 0.00 -0.41 0.00 0.00 54.97 52.99 1ce8 s GLU 619 Cb 0.06 -0.99 -0.10 0.00 -1.78 0.00 0.00 34.13 31.32 1ce8 s GLU 619 CO 0.06 -0.05 1.45 -2.14 -0.49 0.00 0.00 175.26 174.08 1ce8 s PRO 620 N -3.80 4.27 -1.35 0.39 0.02 -1.26 -3.45 135.00 129.83 1ce8 s PRO 620 Ca 0.31 2.28 -0.12 0.00 0.02 0.00 0.00 61.00 63.49 1ce8 s PRO 620 Cb 0.06 -3.13 0.11 0.00 0.02 0.00 0.00 34.50 31.56 1ce8 s PRO 620 CO 0.12 -0.44 1.97 0.28 -0.33 0.00 0.00 177.00 178.61 1ce8 n VAL 621 N 2.72 3.98 -4.41 3.83 0.31 -1.26 -4.50 118.33 119.00 1ce8 n VAL 621 Ca 0.08 -3.88 -0.24 0.00 -0.01 0.00 0.00 64.34 60.30 1ce8 n VAL 621 Cb 0.40 -2.46 -0.09 0.00 -0.91 0.00 0.00 33.84 30.78 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 1.75 2.76 0.17 2.52 -4.23 -1.26 -4.83 115.64 112.50 1ce8 s THR 622 Ca 0.43 -2.19 -0.15 0.00 -1.18 0.00 0.00 61.69 58.61 1ce8 s THR 622 Cb 0.10 -2.55 0.05 0.00 1.34 0.00 0.00 72.50 71.43 1ce8 s THR 622 CO -0.03 -0.35 1.76 0.25 -0.54 0.00 0.00 174.62 175.72 1ce8 h LEU 623 N 2.07 0.22 0.27 4.79 5.85 -1.96 0.57 115.31 127.13 1ce8 h LEU 623 Ca -0.42 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.34 1ce8 h LEU 623 Cb 1.25 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.27 1ce8 h LEU 623 CO 0.62 0.16 -0.28 -0.08 -0.34 0.00 0.00 178.44 178.52 1ce8 h GLU 624 N 0.36 -0.56 -0.44 1.25 4.81 -1.96 0.82 114.58 118.85 1ce8 h GLU 624 Ca 0.19 0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.38 1ce8 h GLU 624 Cb 0.15 0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1ce8 h GLU 624 CO -0.17 -0.38 -0.04 -0.44 -0.73 0.00 0.00 179.01 177.26 1ce8 h ASP 625 N -0.58 0.72 -0.00 1.04 3.32 -1.75 -2.66 116.42 116.50 1ce8 h ASP 625 Ca -0.01 -0.18 -0.19 0.00 0.02 0.00 0.00 57.03 56.67 1ce8 h ASP 625 Cb 0.54 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.90 1ce8 h ASP 625 CO -0.06 0.81 -0.65 0.58 -1.72 0.00 0.00 179.24 178.19 1ce8 h VAL 626 N 0.69 1.32 -0.22 -1.35 2.07 0.41 -3.18 116.25 115.98 1ce8 h VAL 626 Ca 0.13 -1.92 -0.07 0.00 0.82 0.00 0.00 66.70 65.66 1ce8 h VAL 626 Cb 0.48 1.89 -0.01 0.00 -1.52 0.00 0.00 31.29 32.13 1ce8 h VAL 626 CO 0.02 0.60 -0.18 -0.07 0.02 0.00 0.00 177.57 177.96 1ce8 h LEU 627 N 0.45 0.37 -0.90 2.57 3.38 -0.70 -2.42 115.31 118.07 1ce8 h LEU 627 Ca -0.02 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.75 1ce8 h LEU 627 Cb 1.24 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 1ce8 h LEU 627 CO 0.13 0.57 -0.31 -0.33 0.09 0.00 0.00 178.44 178.59 1ce8 h GLU 628 N 0.35 0.43 -0.04 1.13 4.39 -1.48 -0.19 114.58 119.18 1ce8 h GLU 628 Ca 0.06 -0.18 -0.18 0.00 0.34 0.00 0.00 59.36 59.41 1ce8 h GLU 628 Cb 0.52 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 1ce8 h GLU 628 CO 0.03 0.70 -0.75 0.82 -1.16 0.00 0.00 179.01 178.66 1ce8 h ILE 629 N 0.38 1.44 -0.10 3.13 2.04 -1.48 -3.11 117.51 119.81 1ce8 h ILE 629 Ca 0.05 -2.30 -0.18 0.00 1.00 0.00 0.00 64.86 63.43 1ce8 h ILE 629 Cb 0.74 2.24 -0.00 0.00 -0.74 0.00 0.00 36.82 39.05 1ce8 h ILE 629 CO 0.06 0.68 -0.69 0.58 0.00 0.00 0.00 178.15 178.77 1ce8 h VAL 630 N 0.16 1.37 -0.37 1.67 2.07 -1.19 0.45 116.25 120.40 1ce8 h VAL 630 Ca -0.03 -2.07 0.06 0.00 0.82 0.00 0.00 66.70 65.49 1ce8 h VAL 630 Cb 1.32 2.05 -0.06 0.00 -1.52 0.00 0.00 31.29 33.08 1ce8 h VAL 630 CO 0.12 0.62 0.02 -0.09 0.02 0.00 0.00 177.57 178.26 1ce8 h ARG 631 N 0.30 0.12 0.02 1.57 2.43 -0.97 0.26 114.38 118.11 1ce8 h ARG 631 Ca -0.02 -0.01 -0.28 0.00 -0.81 0.00 0.00 59.98 58.86 1ce8 h ARG 631 Cb 1.26 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.74 1ce8 h ARG 631 CO 0.12 0.08 -1.56 -0.84 -1.51 0.00 0.00 179.97 176.26 1ce8 h ILE 632 N 0.12 1.04 0.02 1.20 3.07 -1.46 -3.36 117.51 118.14 1ce8 h ILE 632 Ca 0.18 -2.84 -0.24 0.00 1.55 0.00 0.00 64.86 63.50 1ce8 h ILE 632 Cb 0.24 2.54 0.01 0.00 -0.27 0.00 0.00 36.82 39.33 1ce8 h ILE 632 CO -0.28 0.63 -1.01 -0.33 -1.05 0.00 0.00 178.15 176.11 1ce8 h GLU 633 N 0.01 0.46 -6.22 0.16 4.39 0.03 -3.46 114.58 109.96 1ce8 h GLU 633 Ca -0.23 -0.53 -0.44 0.00 0.34 0.00 0.00 59.36 58.50 1ce8 h GLU 633 Cb 1.96 0.16 0.03 0.00 -0.10 0.00 0.00 28.75 30.80 1ce8 h GLU 633 CO 0.10 1.17 -0.86 1.63 -1.16 0.00 0.00 179.01 179.89 1ce8 n LYS 634 N -3.75 -3.82 -0.67 2.33 5.02 0.92 -4.92 118.16 113.28 1ce8 n LYS 634 Ca -0.08 0.54 -0.30 0.00 -2.02 0.00 0.00 58.31 56.45 1ce8 n LYS 634 Cb 0.87 -4.85 0.26 0.00 -0.02 0.00 0.00 35.03 31.29 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 -6.11 -1.69 -0.06 1.97 0.04 -1.26 -4.91 135.00 122.98 1ce8 s PRO 635 Ca 0.08 0.31 0.05 0.00 0.04 0.00 0.00 61.00 61.48 1ce8 s PRO 635 Cb -0.02 -1.51 -0.24 0.00 0.04 0.00 0.00 34.50 32.76 1ce8 s PRO 635 CO 0.84 -4.10 0.61 -0.22 0.04 0.00 0.00 177.00 174.17 1ce8 h LYS 636 N -2.87 0.10 -1.78 4.56 3.64 -1.49 -3.47 116.57 115.27 1ce8 h LYS 636 Ca -0.50 -0.17 0.01 0.00 -1.27 0.00 0.00 60.65 58.72 1ce8 h LYS 636 Cb 1.33 0.06 -0.21 0.00 -0.41 0.00 0.00 32.23 33.00 1ce8 h LYS 636 CO 0.39 0.77 0.37 0.20 -2.27 0.00 0.00 179.45 178.91 1ce8 s GLY 637 N -5.23 -0.42 -0.07 5.01 0.00 -1.19 -4.85 107.32 100.58 1ce8 s GLY 637 Ca -0.10 1.72 0.05 0.00 0.00 0.00 0.00 44.72 46.39 1ce8 s GLY 637 CO 0.81 1.03 -0.24 0.14 0.00 0.00 0.00 173.10 174.84 1ce8 s VAL 638 N -1.08 2.02 -0.28 1.40 1.01 0.81 -0.83 120.40 123.46 1ce8 s VAL 638 Ca -0.06 -1.04 -0.10 0.00 0.00 0.00 0.00 61.98 60.79 1ce8 s VAL 638 Cb -0.00 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 1ce8 s VAL 638 CO 0.05 0.56 0.15 -0.63 0.00 0.00 0.00 175.10 175.24 1ce8 s ILE 639 N -0.00 4.98 -0.31 2.22 1.01 0.99 -0.19 121.20 129.89 1ce8 s ILE 639 Ca -0.08 0.02 0.12 0.00 0.00 0.00 0.00 60.65 60.71 1ce8 s ILE 639 Cb -0.15 -3.38 -0.16 0.00 0.01 0.00 0.00 42.46 38.79 1ce8 s ILE 639 CO 0.05 0.26 0.40 1.33 0.00 0.00 0.00 174.94 176.97 1ce8 n VAL 640 N 5.02 0.00 1.87 2.92 0.24 -1.26 -1.98 118.33 125.14 1ce8 n VAL 640 Ca -0.15 -0.25 0.16 0.00 -2.04 0.00 0.00 64.34 62.06 1ce8 n VAL 640 Cb 0.52 0.65 0.91 0.00 -1.47 0.00 0.00 33.84 34.44 1ce8 n VAL 640 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ce8 n GLN 641 N -1.57 0.88 0.00 7.34 3.00 -1.26 -3.47 117.38 122.30 1ce8 n GLN 641 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 57.04 1ce8 n GLN 641 Cb 0.24 -1.50 -0.00 0.00 0.00 0.00 0.00 30.24 28.98 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 -1.06 0.00 -0.43 1.08 4.02 -1.26 -2.78 117.16 116.74 1ce8 n TYR 642 Ca 0.22 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 58.21 1ce8 n TYR 642 Cb 0.14 0.00 0.30 0.00 -0.02 0.00 0.00 39.34 39.75 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 0.84 2.69 2.20 2.72 0.00 -1.22 -4.20 105.19 108.22 1ce8 n GLY 643 Ca 0.04 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.32 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 1.21 -0.13 0.25 -0.02 0.00 -1.26 -3.47 105.19 101.77 1ce8 n GLY 644 Ca 0.22 -1.60 -0.06 0.00 0.00 0.00 0.00 46.02 44.59 1ce8 n GLY 644 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1ce8 h GLN 645 N 0.00 0.65 0.16 1.61 1.08 -1.94 -2.95 115.11 113.71 1ce8 h GLN 645 Ca 0.00 -0.25 0.01 0.00 -1.45 0.00 0.00 58.65 56.96 1ce8 h GLN 645 Cb 0.00 -0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 27.35 1ce8 h GLN 645 CO 0.00 0.82 -0.49 1.15 -0.95 0.00 0.00 178.83 179.36 1ce8 h THR 646 N 0.57 0.06 0.00 -0.54 2.02 -1.84 -2.06 112.91 111.12 1ce8 h THR 646 Ca 0.08 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.15 1ce8 h THR 646 Cb 0.69 0.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 1ce8 h THR 646 CO 0.05 0.00 -0.53 1.55 0.37 0.00 0.00 175.52 176.97 1ce8 h PRO 647 N -0.75 0.00 -0.38 6.66 0.13 -1.75 -3.24 132.00 132.67 1ce8 h PRO 647 Ca -0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 1ce8 h PRO 647 Cb 0.75 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.86 1ce8 h PRO 647 CO -0.25 0.53 0.15 1.25 -0.23 0.00 0.00 178.00 179.44 1ce8 h LEU 648 N 0.00 0.53 -1.85 1.56 5.85 -1.32 -2.78 115.31 117.30 1ce8 h LEU 648 Ca -0.01 -0.17 0.06 0.00 0.84 0.00 0.00 57.88 58.61 1ce8 h LEU 648 Cb 1.08 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.96 1ce8 h LEU 648 CO 0.07 0.56 0.23 0.11 -0.34 0.00 0.00 178.44 179.07 1ce8 h LYS 649 N 0.48 0.18 0.00 1.25 1.57 -1.40 -2.41 116.57 116.24 1ce8 h LYS 649 Ca 0.13 -0.01 -0.13 0.00 -1.87 0.00 0.00 60.65 58.77 1ce8 h LYS 649 Cb 0.19 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 1ce8 h LYS 649 CO -0.01 0.12 -0.60 -0.07 -0.57 0.00 0.00 179.45 178.32 1ce8 h LEU 650 N 0.19 0.00 -0.94 2.94 3.38 -1.56 -3.39 115.31 115.93 1ce8 h LEU 650 Ca 0.15 0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.30 1ce8 h LEU 650 Cb 0.37 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 40.95 1ce8 h LEU 650 CO -0.02 0.60 -0.28 0.00 0.09 0.00 0.00 178.44 178.83 1ce8 h ALA 651 N 1.40 0.47 0.57 1.53 0.00 -1.21 0.11 119.26 122.12 1ce8 h ALA 651 Ca -0.01 0.34 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 1ce8 h ALA 651 Cb 1.37 0.80 0.01 0.00 0.00 0.00 0.00 17.79 19.97 1ce8 h ALA 651 CO 0.08 -0.46 -0.27 0.00 0.00 0.00 0.00 179.25 178.59 1ce8 h ARG 652 N -0.01 -0.73 -1.01 0.00 3.08 -1.78 -1.95 114.38 111.99 1ce8 h ARG 652 Ca 0.42 0.05 0.05 0.00 0.07 0.00 0.00 59.98 60.56 1ce8 h ARG 652 Cb 0.66 0.17 -0.06 0.00 0.08 0.00 0.00 29.97 30.82 1ce8 h ARG 652 CO -0.97 -0.47 0.66 0.00 -1.07 0.00 0.00 179.97 178.12 1ce8 h ALA 653 N -0.40 1.37 0.44 0.04 0.00 -1.66 -0.77 119.26 118.27 1ce8 h ALA 653 Ca -0.08 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1ce8 h ALA 653 Cb 0.61 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1ce8 h ALA 653 CO 0.13 0.52 -0.21 -0.07 0.00 0.00 0.00 179.25 179.61 1ce8 h LEU 654 N 1.24 -0.50 -1.02 0.00 3.38 -0.70 0.10 115.31 117.82 1ce8 h LEU 654 Ca 0.41 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.53 1ce8 h LEU 654 Cb 0.06 0.13 -0.09 0.00 0.09 0.00 0.00 40.66 40.85 1ce8 h LEU 654 CO -0.14 -0.33 0.63 -0.08 0.09 0.00 0.00 178.44 178.60 1ce8 h GLU 655 N -0.61 0.89 0.00 1.13 4.81 -0.96 0.20 114.58 120.04 1ce8 h GLU 655 Ca -0.06 -0.05 -0.11 0.00 -0.13 0.00 0.00 59.36 59.00 1ce8 h GLU 655 Cb 0.46 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1ce8 h GLU 655 CO 0.10 0.59 -0.54 0.00 -0.73 0.00 0.00 179.01 178.43 1ce8 h ALA 656 N 1.57 1.10 0.00 2.92 0.00 -0.80 -1.31 119.26 122.73 1ce8 h ALA 656 Ca 0.52 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ce8 h ALA 656 Cb 0.62 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1ce8 h ALA 656 CO -0.30 0.67 0.00 0.00 0.00 0.00 0.00 179.25 179.62 1ce8 n ALA 657 N -2.43 2.60 0.00 0.00 0.00 0.49 -4.85 120.51 116.32 1ce8 n ALA 657 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1ce8 n ALA 657 Cb 0.55 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.65 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 0.79 0.66 3.74 0.00 0.00 -0.49 -5.05 105.19 104.84 1ce8 n GLY 658 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1ce8 n GLY 658 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ce8 s VAL 659 N -2.00 3.80 -1.21 1.61 1.01 0.02 -4.91 120.40 118.72 1ce8 s VAL 659 Ca 0.00 1.59 -0.17 0.00 0.00 0.00 0.00 61.98 63.40 1ce8 s VAL 659 Cb 0.00 -4.01 -0.03 0.00 0.00 0.00 0.00 36.38 32.33 1ce8 s VAL 659 CO 0.00 0.29 2.12 -0.81 0.00 0.00 0.00 175.10 176.70 1ce8 n PRO 660 N 2.18 2.36 -2.09 2.72 -0.04 -1.26 -4.18 135.00 134.68 1ce8 n PRO 660 Ca 0.02 -2.33 -0.42 0.00 -0.04 0.00 0.00 63.50 60.73 1ce8 n PRO 660 Cb 0.46 -3.16 -0.03 0.00 -0.04 0.00 0.00 33.50 30.73 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 3.88 3.50 0.41 0.52 1.01 -1.26 -0.14 120.40 128.32 1ce8 s VAL 661 Ca 0.51 0.84 0.08 0.00 0.00 0.00 0.00 61.98 63.41 1ce8 s VAL 661 Cb 0.14 -3.54 -0.01 0.00 0.00 0.00 0.00 36.38 32.97 1ce8 s VAL 661 CO -0.01 -0.02 0.47 0.27 0.00 0.00 0.00 175.10 175.81 1ce8 s ILE 662 N 2.89 2.94 0.00 2.22 -4.36 0.73 -4.77 121.20 120.86 1ce8 s ILE 662 Ca 0.69 -1.16 0.00 0.00 -0.26 0.00 0.00 60.65 59.92 1ce8 s ILE 662 Cb -0.34 -3.03 0.00 0.00 1.25 0.00 0.00 42.46 40.34 1ce8 s ILE 662 CO 0.28 -0.02 0.00 0.61 0.24 0.00 0.00 174.94 176.06 1ce8 n GLY 663 N -1.69 -1.16 3.70 6.27 0.00 -1.26 -4.61 105.19 106.44 1ce8 n GLY 663 Ca 0.05 -1.24 -0.59 0.00 0.00 0.00 0.00 46.02 44.24 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 0.00 0.23 -1.36 2.61 -1.04 -0.51 -4.83 114.28 109.38 1ce8 n THR 664 Ca 0.00 -0.04 -0.35 0.00 -2.04 0.00 0.00 64.05 61.62 1ce8 n THR 664 Cb 0.00 -1.06 0.10 0.00 -1.82 0.00 0.00 70.33 67.55 1ce8 n THR 664 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1ce8 n SER 665 N 4.86 1.18 -0.15 8.00 2.88 -1.26 -4.82 113.62 124.31 1ce8 n SER 665 Ca 0.26 0.68 -0.03 0.00 -1.33 0.00 0.00 58.87 58.45 1ce8 n SER 665 Cb 0.11 -1.49 0.06 0.00 -0.75 0.00 0.00 64.21 62.13 1ce8 n SER 665 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1ce8 h PRO 666 N -0.31 0.24 -0.51 -1.46 0.11 -1.89 -0.75 132.00 127.43 1ce8 h PRO 666 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1ce8 h PRO 666 Cb 1.32 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.35 1ce8 h PRO 666 CO 0.48 0.16 0.33 0.22 -0.21 0.00 0.00 178.00 178.99 1ce8 h ASP 667 N 0.25 0.59 -0.59 -2.05 3.58 -1.96 0.65 116.42 116.89 1ce8 h ASP 667 Ca 0.24 -0.02 0.03 0.00 0.42 0.00 0.00 57.03 57.70 1ce8 h ASP 667 Cb 0.31 -0.15 -0.04 0.00 1.72 0.00 0.00 39.33 41.17 1ce8 h ASP 667 CO -0.30 0.44 0.36 0.00 -2.88 0.00 0.00 179.24 176.85 1ce8 h ALA 668 N 1.18 0.77 -0.42 -0.78 0.00 -1.64 0.23 119.26 118.60 1ce8 h ALA 668 Ca 0.19 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1ce8 h ALA 668 Cb -0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1ce8 h ALA 668 CO -0.04 0.08 0.26 0.82 0.00 0.00 0.00 179.25 180.37 1ce8 h ILE 669 N 0.70 1.13 -0.02 0.00 2.04 -0.55 -1.09 117.51 119.71 1ce8 h ILE 669 Ca 0.24 -0.27 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 1ce8 h ILE 669 Cb 0.04 0.55 -0.00 0.00 -0.74 0.00 0.00 36.82 36.67 1ce8 h ILE 669 CO -0.11 0.12 -0.04 -0.78 0.00 0.00 0.00 178.15 177.35 1ce8 h ASP 670 N 0.56 0.03 -0.76 1.72 3.58 0.01 0.15 116.42 121.71 1ce8 h ASP 670 Ca 0.15 -0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.57 1ce8 h ASP 670 Cb -0.02 -0.01 -0.04 0.00 1.72 0.00 0.00 39.33 40.98 1ce8 h ASP 670 CO -0.03 0.08 0.38 -0.09 -2.88 0.00 0.00 179.24 176.69 1ce8 h ARG 671 N 0.03 1.09 0.19 0.28 2.43 0.72 -0.06 114.38 119.07 1ce8 h ARG 671 Ca 0.01 -0.15 -0.25 0.00 -0.81 0.00 0.00 59.98 58.78 1ce8 h ARG 671 Cb 0.09 -0.20 0.03 0.00 -0.42 0.00 0.00 29.97 29.47 1ce8 h ARG 671 CO 0.01 0.83 -1.13 0.00 -1.51 0.00 0.00 179.97 178.17 1ce8 h ALA 672 N 1.33 -0.10 0.17 2.80 0.00 -0.69 -1.85 119.26 120.91 1ce8 h ALA 672 Ca 0.27 -0.79 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 1ce8 h ALA 672 Cb 0.09 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1ce8 h ALA 672 CO -0.04 0.54 -0.08 0.93 0.00 0.00 0.00 179.25 180.60 1ce8 h GLU 673 N -0.16 -0.22 -6.28 0.00 4.39 -0.67 -3.43 114.58 108.21 1ce8 h GLU 673 Ca -0.20 0.02 -0.61 0.00 0.34 0.00 0.00 59.36 58.91 1ce8 h GLU 673 Cb 1.87 0.05 0.02 0.00 -0.10 0.00 0.00 28.75 30.59 1ce8 h GLU 673 CO 0.20 0.03 1.12 -3.47 -1.16 0.00 0.00 179.01 175.73 1ce8 n ASP 674 N -5.09 3.53 0.01 1.42 -0.08 -0.05 -4.86 116.55 111.44 1ce8 n ASP 674 Ca -0.09 0.96 -0.10 0.00 -1.51 0.00 0.00 54.79 54.05 1ce8 n ASP 674 Cb 0.20 -1.39 -0.04 0.00 2.34 0.00 0.00 41.12 42.23 1ce8 n ASP 674 CO 0.00 0.00 0.00 0.08 0.12 0.00 0.00 177.20 177.40 1ce8 h ARG 675 N 9.39 -0.34 -0.29 -0.67 -0.00 -1.88 0.14 114.38 120.74 1ce8 h ARG 675 Ca -0.49 0.02 0.03 0.00 -0.00 0.00 0.00 59.98 59.55 1ce8 h ARG 675 Cb 1.27 0.08 -0.03 0.00 -0.00 0.00 0.00 29.97 31.28 1ce8 h ARG 675 CO 0.95 -0.23 0.10 0.93 -0.00 0.00 0.00 179.97 181.72 1ce8 h GLU 676 N -0.35 0.22 -0.44 0.08 5.08 -1.93 -0.58 114.58 116.66 1ce8 h GLU 676 Ca 0.09 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.39 1ce8 h GLU 676 Cb 0.49 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 1ce8 h GLU 676 CO -0.31 0.14 0.09 0.00 -1.00 0.00 0.00 179.01 177.93 1ce8 h ARG 677 N 0.22 0.72 0.73 2.33 2.47 -1.78 -1.98 114.38 117.10 1ce8 h ARG 677 Ca 0.13 -0.18 -0.04 0.00 -1.26 0.00 0.00 59.98 58.63 1ce8 h ARG 677 Cb 0.10 -0.09 0.01 0.00 -1.65 0.00 0.00 29.97 28.34 1ce8 h ARG 677 CO -0.13 0.73 -0.35 0.35 0.56 0.00 0.00 179.97 181.13 1ce8 h PHE 678 N 0.58 -0.91 -0.91 3.04 3.57 0.18 -1.93 116.94 120.56 1ce8 h PHE 678 Ca 0.14 -0.02 0.25 0.00 3.53 0.00 0.00 57.97 61.87 1ce8 h PHE 678 Cb 0.35 0.30 -0.14 0.00 2.79 0.00 0.00 35.95 39.25 1ce8 h PHE 678 CO 0.02 -0.57 0.34 0.37 -2.23 0.00 0.00 178.31 176.25 1ce8 h GLN 679 N -1.26 0.26 -0.12 1.11 4.15 -1.15 0.87 115.11 118.98 1ce8 h GLN 679 Ca -0.10 -0.02 -0.06 0.00 0.77 0.00 0.00 58.65 59.24 1ce8 h GLN 679 Cb 0.75 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.37 1ce8 h GLN 679 CO 0.17 0.18 -0.19 0.45 -1.93 0.00 0.00 178.83 177.50 1ce8 h HIS 680 N 0.27 0.22 0.19 3.99 3.86 -1.33 -1.75 115.15 120.60 1ce8 h HIS 680 Ca 0.60 -0.03 -0.28 0.00 -1.16 0.00 0.00 60.37 59.50 1ce8 h HIS 680 Cb 1.23 -0.06 0.02 0.00 1.06 0.00 0.00 27.41 29.67 1ce8 h HIS 680 CO -0.18 0.39 -1.26 0.00 0.86 0.00 0.00 177.93 177.74 1ce8 h ALA 681 N 1.62 -0.06 -0.77 2.45 0.00 0.14 -2.84 119.26 119.79 1ce8 h ALA 681 Ca 0.04 -0.86 0.12 0.00 0.00 0.00 0.00 54.91 54.20 1ce8 h ALA 681 Cb 0.45 0.22 -0.08 0.00 0.00 0.00 0.00 17.79 18.38 1ce8 h ALA 681 CO 0.03 0.63 0.38 0.28 0.00 0.00 0.00 179.25 180.57 1ce8 h VAL 682 N -0.11 0.78 0.56 0.00 2.07 -0.22 -1.94 116.25 117.39 1ce8 h VAL 682 Ca -0.23 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.06 1ce8 h VAL 682 Cb 1.92 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 31.81 1ce8 h VAL 682 CO 0.19 0.11 -0.33 -0.33 0.02 0.00 0.00 177.57 177.23 1ce8 h GLU 683 N 0.60 -0.81 -1.31 1.57 5.08 -1.39 -1.87 114.58 116.46 1ce8 h GLU 683 Ca 0.40 0.06 0.39 0.00 -1.00 0.00 0.00 59.36 59.20 1ce8 h GLU 683 Cb 0.50 0.18 -0.08 0.00 0.50 0.00 0.00 28.75 29.85 1ce8 h GLU 683 CO -0.32 -0.54 0.90 -0.09 -1.00 0.00 0.00 179.01 177.97 1ce8 h ARG 684 N -0.84 0.11 0.00 2.33 2.43 -1.12 0.87 114.38 118.17 1ce8 h ARG 684 Ca -0.07 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1ce8 h ARG 684 Cb 0.68 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.20 1ce8 h ARG 684 CO 0.07 0.07 -0.59 1.28 -1.51 0.00 0.00 179.97 179.30 1ce8 n LEU 685 N -4.37 0.58 -3.16 3.80 4.77 -0.87 -5.00 117.00 112.75 1ce8 n LEU 685 Ca 0.31 -0.08 -0.05 0.00 -0.03 0.00 0.00 56.01 56.17 1ce8 n LEU 685 Cb 1.33 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 42.22 1ce8 n LEU 685 CO 0.33 0.14 0.22 0.29 -1.33 0.00 0.00 177.39 177.04 1ce8 n LYS 686 N -1.52 -1.47 -4.51 3.23 5.02 0.30 -5.06 118.16 114.16 1ce8 n LYS 686 Ca 0.05 1.45 -0.26 0.00 -2.02 0.00 0.00 58.31 57.54 1ce8 n LYS 686 Cb 0.34 -5.18 -0.08 0.00 -0.02 0.00 0.00 35.03 30.09 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 -3.97 1.98 -0.24 -0.35 1.02 -1.14 -5.05 118.68 110.93 1ce8 s LEU 687 Ca 0.03 -1.71 -0.18 0.00 0.02 0.00 0.00 54.13 52.30 1ce8 s LEU 687 Cb -0.01 -0.05 -0.03 0.00 0.02 0.00 0.00 46.19 46.12 1ce8 s LEU 687 CO 0.78 -0.96 0.51 -0.54 0.02 0.00 0.00 176.35 176.15 1ce8 s LYS 688 N -3.68 4.12 0.00 1.70 1.02 -1.26 -4.81 119.74 116.83 1ce8 s LYS 688 Ca 0.24 0.34 0.03 0.00 0.02 0.00 0.00 55.97 56.60 1ce8 s LYS 688 Cb 0.02 -3.61 -0.01 0.00 -0.52 0.00 0.00 37.83 33.71 1ce8 s LYS 688 CO 0.15 -0.26 -0.09 -1.14 -0.92 0.00 0.00 175.35 173.09 1ce8 s GLN 689 N 2.00 0.71 0.46 1.68 0.74 -1.26 0.14 119.66 124.12 1ce8 s GLN 689 Ca 0.22 -0.40 -0.23 0.00 0.05 0.00 0.00 55.36 55.00 1ce8 s GLN 689 Cb -0.15 -0.67 -0.07 0.00 1.10 0.00 0.00 33.01 33.21 1ce8 s GLN 689 CO 0.09 0.18 1.18 -2.14 -0.55 0.00 0.00 175.29 174.05 1ce8 s PRO 690 N -0.44 3.76 0.20 1.67 0.02 -1.26 -4.92 135.00 134.02 1ce8 s PRO 690 Ca 0.02 1.82 -0.33 0.00 0.02 0.00 0.00 61.00 62.53 1ce8 s PRO 690 Cb -0.04 -2.44 -0.13 0.00 0.02 0.00 0.00 34.50 31.91 1ce8 s PRO 690 CO -0.00 -0.56 1.68 0.00 -0.33 0.00 0.00 177.00 177.79 1ce8 n ALA 691 N -0.44 2.42 -4.08 -1.55 0.00 -1.26 -4.76 120.51 110.83 1ce8 n ALA 691 Ca 0.07 0.41 -0.20 0.00 0.00 0.00 0.00 53.44 53.72 1ce8 n ALA 691 Cb 0.48 -2.47 -0.07 0.00 0.00 0.00 0.00 19.45 17.39 1ce8 n ALA 691 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1ce8 n ASN 692 N 3.77 -0.49 -3.56 0.00 0.23 -1.26 -0.48 115.26 113.47 1ce8 n ASN 692 Ca 0.16 -2.86 -0.06 0.00 -0.53 0.00 0.00 54.58 51.29 1ce8 n ASN 692 Cb 0.33 1.39 -0.02 0.00 -2.08 0.00 0.00 39.78 39.40 1ce8 n ASN 692 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ce8 s ALA 693 N -3.13 -1.89 -0.29 -2.53 0.00 0.38 -4.96 121.76 109.34 1ce8 s ALA 693 Ca 0.33 1.06 0.01 0.00 0.00 0.00 0.00 51.96 53.36 1ce8 s ALA 693 Cb 0.02 0.30 0.06 0.00 0.00 0.00 0.00 23.12 23.50 1ce8 s ALA 693 CO 0.23 -0.72 -0.04 0.99 0.00 0.00 0.00 175.76 176.22 1ce8 s THR 694 N -2.93 2.51 0.26 0.00 2.01 -1.26 -0.78 115.64 115.45 1ce8 s THR 694 Ca 0.07 -1.63 0.07 0.00 0.31 0.00 0.00 61.69 60.51 1ce8 s THR 694 Cb -0.01 -2.51 -0.03 0.00 0.01 0.00 0.00 72.50 69.96 1ce8 s THR 694 CO -0.07 -0.14 0.24 -0.69 -0.69 0.00 0.00 174.62 173.28 1ce8 s VAL 695 N 1.14 4.46 -0.06 3.82 1.01 0.63 -4.92 120.40 126.47 1ce8 s VAL 695 Ca -0.05 -1.32 -0.04 0.00 0.00 0.00 0.00 61.98 60.57 1ce8 s VAL 695 Cb -0.20 -3.45 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 1ce8 s VAL 695 CO -0.04 -0.32 -0.10 0.41 0.00 0.00 0.00 175.10 175.05 1ce8 n THR 696 N -1.26 0.58 -3.96 3.92 -1.04 -1.26 -1.72 114.28 109.55 1ce8 n THR 696 Ca -0.07 -0.03 -0.23 0.00 -2.04 0.00 0.00 64.05 61.68 1ce8 n THR 696 Cb 0.58 -1.64 -0.05 0.00 -1.82 0.00 0.00 70.33 67.40 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 -2.16 3.67 0.00 2.41 0.00 -1.26 -4.87 121.76 119.55 1ce8 s ALA 697 Ca -0.10 -1.84 0.00 0.00 0.00 0.00 0.00 51.96 50.02 1ce8 s ALA 697 Cb 0.04 -0.82 0.00 0.00 0.00 0.00 0.00 23.12 22.34 1ce8 s ALA 697 CO 0.13 -0.04 0.64 -0.89 0.00 0.00 0.00 175.76 175.61 1ce8 n ILE 698 N -1.27 0.00 0.09 0.00 -0.00 -1.26 -2.45 119.36 114.47 1ce8 n ILE 698 Ca -0.02 1.14 0.20 0.00 -0.00 0.00 0.00 62.75 64.08 1ce8 n ILE 698 Cb 0.61 -1.98 0.66 0.00 -0.00 0.00 0.00 39.64 38.94 1ce8 n ILE 698 CO 0.00 0.00 0.00 -0.33 -0.00 0.00 0.00 176.55 176.22 1ce8 h GLU 699 N 0.00 0.00 -0.03 0.38 4.39 -1.99 0.44 114.58 117.77 1ce8 h GLU 699 Ca 0.00 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.71 1ce8 h GLU 699 Cb 0.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 1ce8 h GLU 699 CO 0.00 0.00 -0.01 1.98 -1.16 0.00 0.00 179.01 179.82 1ce8 h MET 700 N 0.00 -0.00 -0.27 2.33 4.05 -1.94 -2.66 114.93 116.44 1ce8 h MET 700 Ca 0.21 0.00 -0.16 0.00 -0.28 0.00 0.00 59.70 59.47 1ce8 h MET 700 Cb 1.42 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.21 1ce8 h MET 700 CO -0.00 -0.00 -0.47 0.00 0.23 0.00 0.00 176.91 176.66 1ce8 h ALA 701 N 1.03 0.65 -0.75 0.39 0.00 0.19 -1.75 119.26 119.03 1ce8 h ALA 701 Ca 0.02 -0.48 0.05 0.00 0.00 0.00 0.00 54.91 54.50 1ce8 h ALA 701 Cb 0.03 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 1ce8 h ALA 701 CO -0.04 0.67 0.45 0.28 0.00 0.00 0.00 179.25 180.62 1ce8 h VAL 702 N 0.57 1.03 -0.02 0.00 2.07 -1.16 0.64 116.25 119.38 1ce8 h VAL 702 Ca 0.03 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 1ce8 h VAL 702 Cb 1.03 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 1ce8 h VAL 702 CO 0.10 0.15 -0.04 -0.33 0.02 0.00 0.00 177.57 177.47 1ce8 h GLU 703 N 0.84 0.07 -0.92 1.57 5.08 -1.47 -2.64 114.58 117.10 1ce8 h GLU 703 Ca 0.32 -0.05 0.06 0.00 -1.00 0.00 0.00 59.36 58.70 1ce8 h GLU 703 Cb 0.14 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.33 1ce8 h GLU 703 CO -0.16 0.62 0.58 -0.22 -1.00 0.00 0.00 179.01 178.83 1ce8 h LYS 704 N -0.47 1.03 -0.60 2.33 1.63 -0.97 -0.90 116.57 118.62 1ce8 h LYS 704 Ca 0.00 -0.06 0.10 0.00 -0.85 0.00 0.00 60.65 59.84 1ce8 h LYS 704 Cb 0.62 -0.23 -0.07 0.00 -0.60 0.00 0.00 32.23 31.94 1ce8 h LYS 704 CO 0.01 0.68 0.21 0.00 -3.45 0.00 0.00 179.45 176.89 1ce8 h ALA 705 N 1.43 0.76 -0.77 5.00 0.00 0.33 0.18 119.26 126.19 1ce8 h ALA 705 Ca 0.40 0.09 0.16 0.00 0.00 0.00 0.00 54.91 55.57 1ce8 h ALA 705 Cb 0.18 0.08 -0.11 0.00 0.00 0.00 0.00 17.79 17.94 1ce8 h ALA 705 CO -0.18 -0.22 0.25 -0.22 0.00 0.00 0.00 179.25 178.89 1ce8 h LYS 706 N 0.37 0.34 0.77 0.00 1.63 -0.80 0.47 116.57 119.35 1ce8 h LYS 706 Ca 0.30 -0.02 -0.04 0.00 -0.85 0.00 0.00 60.65 60.05 1ce8 h LYS 706 Cb 0.39 -0.08 0.01 0.00 -0.60 0.00 0.00 32.23 31.95 1ce8 h LYS 706 CO -0.32 0.22 -0.39 0.93 -3.45 0.00 0.00 179.45 176.44 1ce8 h GLU 707 N 0.35 -1.02 -0.30 1.90 5.08 -0.18 -3.16 114.58 117.24 1ce8 h GLU 707 Ca 0.44 0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.86 1ce8 h GLU 707 Cb 0.74 0.23 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 1ce8 h GLU 707 CO -0.48 -0.68 0.13 0.82 -1.00 0.00 0.00 179.01 177.80 1ce8 h ILE 708 N -1.06 1.12 0.00 3.13 2.04 -0.91 -3.49 117.51 118.34 1ce8 h ILE 708 Ca -0.11 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.41 1ce8 h ILE 708 Cb 0.82 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 1ce8 h ILE 708 CO 0.16 0.13 0.00 0.61 0.00 0.00 0.00 178.15 179.05 1ce8 n GLY 709 N -1.30 -1.02 3.91 5.37 0.00 0.16 -4.88 105.19 107.44 1ce8 n GLY 709 Ca 0.01 -1.40 -0.27 0.00 0.00 0.00 0.00 46.02 44.37 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 -2.55 3.33 0.63 1.61 1.51 -1.26 -4.57 117.35 116.06 1ce8 s TYR 710 Ca 0.00 0.69 -0.11 0.00 -1.01 0.00 0.00 57.07 56.64 1ce8 s TYR 710 Cb 0.00 -2.63 -0.03 0.00 -0.11 0.00 0.00 41.96 39.19 1ce8 s TYR 710 CO 0.00 -0.69 1.04 -1.25 -1.11 0.00 0.00 175.55 173.54 1ce8 s PRO 711 N -4.93 3.44 0.24 -1.71 0.05 -1.26 -4.93 135.00 125.90 1ce8 s PRO 711 Ca 0.52 0.83 0.10 0.00 0.05 0.00 0.00 61.00 62.51 1ce8 s PRO 711 Cb -0.10 -2.06 -0.04 0.00 0.05 0.00 0.00 34.50 32.34 1ce8 s PRO 711 CO 0.45 -0.69 -0.11 -0.51 0.05 0.00 0.00 177.00 176.19 1ce8 s LEU 712 N -5.17 2.87 -0.41 -3.56 1.02 0.55 -0.36 118.68 113.62 1ce8 s LEU 712 Ca 0.56 -0.76 -0.05 0.00 0.02 0.00 0.00 54.13 53.91 1ce8 s LEU 712 Cb -0.12 -1.46 0.10 0.00 0.02 0.00 0.00 46.19 44.73 1ce8 s LEU 712 CO 0.52 0.06 0.21 -0.69 0.02 0.00 0.00 176.35 176.47 1ce8 s VAL 713 N -2.12 3.52 -0.27 -1.59 1.01 0.20 0.58 120.40 121.73 1ce8 s VAL 713 Ca 0.28 -1.85 -0.14 0.00 0.00 0.00 0.00 61.98 60.27 1ce8 s VAL 713 Cb -0.07 -3.32 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 1ce8 s VAL 713 CO 0.16 -0.61 0.34 -0.69 0.00 0.00 0.00 175.10 174.30 1ce8 s VAL 714 N 1.23 5.20 -0.14 2.92 1.01 0.15 -1.96 120.40 128.80 1ce8 s VAL 714 Ca 0.06 0.47 0.00 0.00 0.00 0.00 0.00 61.98 62.51 1ce8 s VAL 714 Cb -0.23 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.47 1ce8 s VAL 714 CO -0.02 0.16 -0.15 -0.13 0.00 0.00 0.00 175.10 174.96 1ce8 s ARG 715 N 2.01 3.27 -0.05 2.72 0.52 0.22 -1.41 118.95 126.24 1ce8 s ARG 715 Ca 0.13 -0.73 -0.03 0.00 -0.52 0.00 0.00 55.73 54.58 1ce8 s ARG 715 Cb -0.16 -2.62 -0.01 0.00 0.52 0.00 0.00 34.95 32.68 1ce8 s ARG 715 CO 0.10 0.09 -0.06 -1.00 0.02 0.00 0.00 175.30 174.45 1ce8 h PRO 716 N 7.08 0.00 -6.42 3.54 0.14 -1.96 0.32 132.00 134.70 1ce8 h PRO 716 Ca -0.29 0.00 -0.31 0.00 0.14 0.00 0.00 66.00 65.54 1ce8 h PRO 716 Cb 1.20 0.00 0.02 0.00 0.14 0.00 0.00 31.00 32.36 1ce8 h PRO 716 CO 0.56 0.00 -1.13 0.00 0.14 0.00 0.00 178.00 177.57 1ce8 n ALA 724 N -2.71 -2.33 -2.80 -0.56 0.00 -1.26 -4.61 120.51 106.23 1ce8 n ALA 724 Ca -0.02 0.37 -0.36 0.00 0.00 0.00 0.00 53.44 53.43 1ce8 n ALA 724 Cb 0.09 -2.15 -0.10 0.00 0.00 0.00 0.00 19.45 17.28 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 -2.28 3.92 0.28 0.00 0.00 -1.26 -5.04 119.30 114.92 1ce8 s MET 725 Ca 0.33 -0.35 0.12 0.00 0.00 0.00 0.00 55.69 55.78 1ce8 s MET 725 Cb -0.04 -3.38 -0.05 0.00 0.00 0.00 0.00 34.83 31.36 1ce8 s MET 725 CO 0.76 0.05 -0.19 -2.00 0.00 0.00 0.00 175.02 173.65 1ce8 s GLU 726 N 1.02 1.72 -0.28 3.16 2.12 -0.50 -4.79 118.70 121.15 1ce8 s GLU 726 Ca 0.05 -1.74 -0.08 0.00 0.36 0.00 0.00 54.97 53.56 1ce8 s GLU 726 Cb -0.14 -1.80 -0.02 0.00 0.26 0.00 0.00 34.13 32.44 1ce8 s GLU 726 CO 0.04 0.33 0.11 0.42 -0.54 0.00 0.00 175.26 175.62 1ce8 s ILE 727 N -2.48 4.45 -0.14 -3.70 1.01 -1.26 0.32 121.20 119.40 1ce8 s ILE 727 Ca 0.30 -0.31 -0.06 0.00 0.00 0.00 0.00 60.65 60.57 1ce8 s ILE 727 Cb -0.05 -3.19 -0.04 0.00 0.01 0.00 0.00 42.46 39.19 1ce8 s ILE 727 CO 0.15 0.19 0.08 -0.69 0.00 0.00 0.00 174.94 174.67 1ce8 s VAL 728 N 1.61 4.97 -0.16 2.92 1.01 0.20 -4.80 120.40 126.14 1ce8 s VAL 728 Ca 0.05 0.02 0.15 0.00 0.00 0.00 0.00 61.98 62.20 1ce8 s VAL 728 Cb -0.16 -3.19 -0.22 0.00 0.00 0.00 0.00 36.38 32.81 1ce8 s VAL 728 CO 0.05 0.54 0.39 -1.22 0.00 0.00 0.00 175.10 174.87 1ce8 n TYR 729 N 2.73 0.00 -4.01 5.22 4.02 -1.26 0.20 117.16 124.06 1ce8 n TYR 729 Ca -0.18 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.58 1ce8 n TYR 729 Cb 0.53 -0.27 -0.03 0.00 -0.02 0.00 0.00 39.34 39.55 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 -3.46 0.58 0.08 7.72 1.47 -1.26 -4.67 116.67 117.13 1ce8 s ASP 730 Ca -0.03 -1.34 -0.22 0.00 1.18 0.00 0.00 52.55 52.14 1ce8 s ASP 730 Cb 0.10 0.70 -0.13 0.00 -0.34 0.00 0.00 42.92 43.26 1ce8 s ASP 730 CO 0.62 -1.38 1.64 -0.08 0.68 0.00 0.00 175.17 176.66 1ce8 h GLU 731 N 2.10 0.13 -0.26 2.11 4.81 -1.97 -0.18 114.58 121.31 1ce8 h GLU 731 Ca -0.29 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 58.98 1ce8 h GLU 731 Cb 1.24 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 30.55 1ce8 h GLU 731 CO 0.39 0.21 -0.09 0.00 -0.73 0.00 0.00 179.01 178.79 1ce8 h ALA 732 N 0.91 0.14 -0.84 2.92 0.00 -1.99 -0.72 119.26 119.68 1ce8 h ALA 732 Ca 0.03 0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.13 1ce8 h ALA 732 Cb 0.12 0.24 -0.07 0.00 0.00 0.00 0.00 17.79 18.08 1ce8 h ALA 732 CO -0.00 -0.49 0.49 0.22 0.00 0.00 0.00 179.25 179.46 1ce8 h ASP 733 N -0.04 0.72 0.76 0.00 1.82 -1.93 0.19 116.42 117.94 1ce8 h ASP 733 Ca 0.13 0.04 -0.03 0.00 -0.39 0.00 0.00 57.03 56.78 1ce8 h ASP 733 Cb 0.24 -0.10 -0.00 0.00 0.68 0.00 0.00 39.33 40.14 1ce8 h ASP 733 CO -0.29 0.42 -0.47 0.25 -1.61 0.00 0.00 179.24 177.54 1ce8 h LEU 734 N 0.83 -1.19 -0.60 2.28 5.85 -0.23 -1.53 115.31 120.72 1ce8 h LEU 734 Ca 0.40 0.07 0.12 0.00 0.84 0.00 0.00 57.88 59.31 1ce8 h LEU 734 Cb 0.34 0.35 -0.12 0.00 0.37 0.00 0.00 40.66 41.60 1ce8 h LEU 734 CO -0.24 -0.72 -0.18 0.03 -0.34 0.00 0.00 178.44 176.99 1ce8 h ARG 735 N -1.16 -0.03 -0.65 1.25 3.08 -0.63 -1.58 114.38 114.66 1ce8 h ARG 735 Ca -0.10 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.08 1ce8 h ARG 735 Cb 0.93 0.01 -0.12 0.00 0.08 0.00 0.00 29.97 30.86 1ce8 h ARG 735 CO 0.10 -0.02 -0.21 -0.09 -1.07 0.00 0.00 179.97 178.67 1ce8 h ARG 736 N -0.03 -0.05 -0.87 0.04 2.43 -0.35 0.12 114.38 115.66 1ce8 h ARG 736 Ca 0.29 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.45 1ce8 h ARG 736 Cb 0.47 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.99 1ce8 h ARG 736 CO -0.64 -0.03 0.52 -0.92 -1.51 0.00 0.00 179.97 177.39 1ce8 h TYR 737 N -0.05 1.16 -0.99 2.20 3.20 -0.30 -2.95 116.97 119.23 1ce8 h TYR 737 Ca 0.30 -0.00 0.14 0.00 3.14 0.00 0.00 58.73 62.30 1ce8 h TYR 737 Cb 0.51 -0.38 -0.09 0.00 1.54 0.00 0.00 36.73 38.32 1ce8 h TYR 737 CO -0.57 0.77 0.62 0.74 -1.64 0.00 0.00 178.16 178.09 1ce8 h PHE 738 N 1.20 1.10 0.66 -3.82 -1.00 -0.28 0.30 116.94 115.11 1ce8 h PHE 738 Ca 0.31 0.03 -0.03 0.00 2.81 0.00 0.00 57.97 61.09 1ce8 h PHE 738 Cb -0.04 -0.35 0.01 0.00 3.61 0.00 0.00 35.95 39.18 1ce8 h PHE 738 CO 0.00 0.40 -0.32 0.37 -1.61 0.00 0.00 178.31 177.15 1ce8 h GLN 739 N 0.92 -0.85 -0.98 1.51 -0.00 -1.32 -3.00 115.11 111.40 1ce8 h GLN 739 Ca 0.51 0.06 0.29 0.00 -0.00 0.00 0.00 58.65 59.50 1ce8 h GLN 739 Cb 0.59 0.19 -0.04 0.00 0.00 0.00 0.00 27.48 28.23 1ce8 h GLN 739 CO -0.28 -0.57 0.72 1.79 0.00 0.00 0.00 178.83 180.49 1ce8 h THR 740 N -0.96 0.49 0.00 2.39 1.35 -1.49 -3.53 112.91 111.17 1ce8 h THR 740 Ca -0.09 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 1ce8 h THR 740 Cb 0.68 0.50 0.00 0.00 -1.73 0.00 0.00 68.15 67.59 1ce8 h THR 740 CO 0.15 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.42 1ce8 n ALA 741 N -2.72 0.00 0.00 6.62 0.00 0.10 -5.12 120.51 119.40 1ce8 n ALA 741 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.65 1ce8 n ALA 741 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.51 1ce8 n ALA 741 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ce8 n VAL 750 N -0.30 0.00 -3.00 0.00 0.31 -0.70 -5.09 118.33 109.56 1ce8 n VAL 750 Ca 0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 63.93 1ce8 n VAL 750 Cb 0.00 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 32.89 1ce8 n VAL 750 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1ce8 s LEU 751 N 0.00 4.30 -0.13 7.52 1.02 0.10 -0.27 118.68 131.22 1ce8 s LEU 751 Ca 0.00 1.22 0.01 0.00 0.02 0.00 0.00 54.13 55.38 1ce8 s LEU 751 Cb 0.00 -3.14 -0.00 0.00 0.02 0.00 0.00 46.19 43.06 1ce8 s LEU 751 CO 0.00 -0.17 -0.17 -0.76 0.02 0.00 0.00 176.35 175.27 1ce8 s LEU 752 N 1.04 2.43 -0.02 1.79 1.02 0.04 -0.61 118.68 124.38 1ce8 s LEU 752 Ca 0.39 -0.46 -0.01 0.00 0.02 0.00 0.00 54.13 54.07 1ce8 s LEU 752 Cb -0.18 -1.53 0.01 0.00 0.02 0.00 0.00 46.19 44.50 1ce8 s LEU 752 CO 0.18 0.13 0.04 -1.81 0.02 0.00 0.00 176.35 174.90 1ce8 s ASP 753 N 0.57 -0.03 0.01 2.29 1.11 -0.83 -0.47 116.67 119.32 1ce8 s ASP 753 Ca -0.10 0.08 -0.30 0.00 0.18 0.00 0.00 52.55 52.40 1ce8 s ASP 753 Cb -0.16 0.07 -0.05 0.00 1.07 0.00 0.00 42.92 43.84 1ce8 s ASP 753 CO 0.04 -0.03 1.32 -2.28 1.18 0.00 0.00 175.17 175.40 1ce8 s HIS 754 N 0.14 3.08 0.12 4.23 5.65 0.36 0.62 115.29 129.49 1ce8 s HIS 754 Ca -0.01 1.01 -0.30 0.00 0.25 0.00 0.00 55.06 56.01 1ce8 s HIS 754 Cb -0.02 -3.56 -0.06 0.00 -1.18 0.00 0.00 32.58 27.76 1ce8 s HIS 754 CO -0.00 -1.96 1.00 0.12 -0.65 0.00 0.00 174.74 173.24 1ce8 s PHE 755 N 1.97 3.75 -0.67 3.88 5.36 0.51 -4.75 117.98 128.03 1ce8 s PHE 755 Ca 0.61 1.74 -0.14 0.00 -0.96 0.00 0.00 56.93 58.18 1ce8 s PHE 755 Cb -0.30 -3.11 0.17 0.00 -0.34 0.00 0.00 43.02 39.44 1ce8 s PHE 755 CO 0.26 -0.01 0.62 -0.51 -1.46 0.00 0.00 175.22 174.12 1ce8 s LEU 756 N -0.01 6.42 0.63 6.12 1.43 -1.26 -4.53 118.68 127.48 1ce8 s LEU 756 Ca 0.48 -2.24 -0.17 0.00 -1.03 0.00 0.00 54.13 51.17 1ce8 s LEU 756 Cb -0.25 -2.19 -0.02 0.00 0.03 0.00 0.00 46.19 43.76 1ce8 s LEU 756 CO 0.31 -0.71 1.13 -0.62 0.23 0.00 0.00 176.35 176.69 1ce8 s ASP 757 N 2.82 5.19 -1.65 2.29 2.15 -1.26 -3.70 116.67 122.52 1ce8 s ASP 757 Ca 0.10 2.12 -0.17 0.00 0.43 0.00 0.00 52.55 55.03 1ce8 s ASP 757 Cb -0.20 -2.57 0.14 0.00 -0.30 0.00 0.00 42.92 39.99 1ce8 s ASP 757 CO -0.03 -1.58 0.80 0.47 -0.17 0.00 0.00 175.17 174.66 1ce8 n ASP 758 N -2.06 -3.60 -4.79 -0.34 8.00 -1.26 -4.95 116.55 107.55 1ce8 n ASP 758 Ca 0.11 -0.92 -0.22 0.00 0.71 0.00 0.00 54.79 54.47 1ce8 n ASP 758 Cb 0.51 -2.93 -0.05 0.00 -0.02 0.00 0.00 41.12 38.63 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 -3.24 3.52 -0.22 2.24 0.00 -1.24 -4.85 121.76 117.96 1ce8 s ALA 759 Ca 0.71 -1.48 -0.09 0.00 0.00 0.00 0.00 51.96 51.11 1ce8 s ALA 759 Cb -0.38 -1.19 -0.04 0.00 0.00 0.00 0.00 23.12 21.50 1ce8 s ALA 759 CO 0.88 0.24 0.11 0.08 0.00 0.00 0.00 175.76 177.06 1ce8 s VAL 760 N -2.18 4.91 -0.07 0.00 1.01 -0.96 -2.65 120.40 120.47 1ce8 s VAL 760 Ca 0.33 0.02 -0.16 0.00 0.00 0.00 0.00 61.98 62.18 1ce8 s VAL 760 Cb -0.07 -3.27 -0.05 0.00 0.00 0.00 0.00 36.38 32.99 1ce8 s VAL 760 CO 0.24 0.38 0.41 -0.70 0.00 0.00 0.00 175.10 175.43 1ce8 s GLU 761 N 0.98 4.11 0.04 2.72 2.12 -1.26 -0.40 118.70 127.02 1ce8 s GLU 761 Ca 0.05 0.37 0.07 0.00 0.36 0.00 0.00 54.97 55.83 1ce8 s GLU 761 Cb -0.14 -3.32 -0.03 0.00 0.26 0.00 0.00 34.13 30.90 1ce8 s GLU 761 CO 0.03 0.45 -0.21 0.08 -0.54 0.00 0.00 175.26 175.07 1ce8 s VAL 762 N -0.27 1.68 -0.08 3.70 1.01 0.11 -1.41 120.40 125.14 1ce8 s VAL 762 Ca 0.23 -1.21 0.04 0.00 0.00 0.00 0.00 61.98 61.04 1ce8 s VAL 762 Cb -0.16 -1.46 -0.00 0.00 0.00 0.00 0.00 36.38 34.76 1ce8 s VAL 762 CO 0.11 0.20 -0.22 -1.81 0.00 0.00 0.00 175.10 173.39 1ce8 s ASP 763 N -1.20 2.78 -0.11 3.32 1.01 -0.41 -0.29 116.67 121.77 1ce8 s ASP 763 Ca 0.08 -0.49 0.00 0.00 0.71 0.00 0.00 52.55 52.85 1ce8 s ASP 763 Cb -0.09 -1.13 0.02 0.00 1.01 0.00 0.00 42.92 42.73 1ce8 s ASP 763 CO 0.02 0.15 -0.10 -0.69 0.21 0.00 0.00 175.17 174.76 1ce8 s VAL 764 N 0.27 1.19 -0.12 -1.27 1.01 0.42 0.12 120.40 122.01 1ce8 s VAL 764 Ca -0.14 -0.41 -0.06 0.00 0.00 0.00 0.00 61.98 61.37 1ce8 s VAL 764 Cb -0.16 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 1ce8 s VAL 764 CO 0.07 0.39 0.09 -1.81 0.00 0.00 0.00 175.10 173.84 1ce8 s ASP 765 N 1.46 6.00 0.10 3.32 1.01 0.10 -0.43 116.67 128.23 1ce8 s ASP 765 Ca 0.01 0.34 -0.25 0.00 0.71 0.00 0.00 52.55 53.36 1ce8 s ASP 765 Cb -0.13 -1.89 0.08 0.00 1.01 0.00 0.00 42.92 41.99 1ce8 s ASP 765 CO -0.07 0.37 0.73 0.00 0.21 0.00 0.00 175.17 176.41 1ce8 s ALA 766 N -0.83 -1.68 -0.06 5.23 0.00 -0.63 0.28 121.76 124.07 1ce8 s ALA 766 Ca 0.13 0.68 0.05 0.00 0.00 0.00 0.00 51.96 52.82 1ce8 s ALA 766 Cb -0.12 0.69 -0.02 0.00 0.00 0.00 0.00 23.12 23.68 1ce8 s ALA 766 CO 0.03 -0.75 -0.21 0.42 0.00 0.00 0.00 175.76 175.25 1ce8 s ILE 767 N -3.49 2.39 -0.07 0.00 1.01 0.64 -1.05 121.20 120.63 1ce8 s ILE 767 Ca 0.03 -0.95 0.01 0.00 0.00 0.00 0.00 60.65 59.74 1ce8 s ILE 767 Cb -0.01 -1.90 0.02 0.00 0.01 0.00 0.00 42.46 40.58 1ce8 s ILE 767 CO -0.11 0.57 -0.10 0.00 0.00 0.00 0.00 174.94 175.31 1ce8 n ASP 769 N 4.14 4.45 0.00 0.00 5.68 -0.54 -1.52 116.55 128.76 1ce8 n ASP 769 Ca -0.21 -2.54 0.00 0.00 -0.50 0.00 0.00 54.79 51.54 1ce8 n ASP 769 Cb 0.51 -0.53 0.00 0.00 -1.14 0.00 0.00 41.12 39.96 1ce8 n ASP 769 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ce8 n GLY 770 N 0.68 2.34 0.07 6.12 0.00 -1.25 -4.59 105.19 108.56 1ce8 n GLY 770 Ca 0.23 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.96 1.02 -4.03 1.61 2.13 -1.26 -5.06 120.64 113.08 1ce8 n GLU 771 Ca 0.00 0.05 -0.10 0.00 0.66 0.00 0.00 57.16 57.77 1ce8 n GLU 771 Cb 0.00 -1.30 -0.06 0.00 0.27 0.00 0.00 31.44 30.35 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 -2.30 1.56 -0.08 5.31 0.23 -1.26 -5.16 119.30 117.59 1ce8 s MET 772 Ca -0.15 -1.36 0.02 0.00 -1.03 0.00 0.00 55.69 53.17 1ce8 s MET 772 Cb 0.05 0.44 0.01 0.00 -1.53 0.00 0.00 34.83 33.81 1ce8 s MET 772 CO 0.40 -0.63 -0.13 0.08 -2.03 0.00 0.00 175.02 172.71 1ce8 s VAL 773 N -3.90 1.23 -0.24 5.16 1.01 -1.26 -1.47 120.40 120.93 1ce8 s VAL 773 Ca 0.25 -0.50 -0.06 0.00 0.00 0.00 0.00 61.98 61.67 1ce8 s VAL 773 Cb 0.00 -1.14 -0.02 0.00 0.00 0.00 0.00 36.38 35.23 1ce8 s VAL 773 CO 0.11 0.38 0.02 -0.22 0.00 0.00 0.00 175.10 175.39 1ce8 s LEU 774 N 0.88 3.25 -0.52 3.92 2.96 0.69 -4.95 118.68 124.92 1ce8 s LEU 774 Ca -0.10 -0.33 -0.28 0.00 -0.22 0.00 0.00 54.13 53.19 1ce8 s LEU 774 Cb -0.15 -1.84 0.01 0.00 0.50 0.00 0.00 46.19 44.71 1ce8 s LEU 774 CO 0.01 -0.04 1.38 -0.63 -1.32 0.00 0.00 176.35 175.75 1ce8 s ILE 775 N 1.55 3.86 -0.02 6.68 -1.09 -1.26 -0.26 121.20 130.65 1ce8 s ILE 775 Ca 0.06 0.79 -0.22 0.00 -2.23 0.00 0.00 60.65 59.04 1ce8 s ILE 775 Cb -0.15 -4.40 -0.22 0.00 -1.58 0.00 0.00 42.46 36.10 1ce8 s ILE 775 CO 0.01 -1.06 1.09 1.23 -1.23 0.00 0.00 174.94 174.98 1ce8 h GLY 776 N 12.67 0.31 -5.97 6.18 0.00 -0.51 -3.40 103.07 112.35 1ce8 h GLY 776 Ca -0.27 -0.51 0.20 0.00 0.00 0.00 0.00 47.33 46.75 1ce8 h GLY 776 CO 1.15 0.45 0.89 -0.32 0.00 0.00 0.00 176.54 178.71 1ce8 s GLY 777 N -3.92 0.38 -0.31 4.60 0.00 -0.08 -4.75 107.32 103.24 1ce8 s GLY 777 Ca -0.15 3.57 -0.06 0.00 0.00 0.00 0.00 44.72 48.09 1ce8 s GLY 777 CO 0.77 1.97 0.07 -0.42 0.00 0.00 0.00 173.10 175.49 1ce8 s ILE 778 N 0.05 3.68 -0.11 0.90 1.01 -1.26 0.02 121.20 125.49 1ce8 s ILE 778 Ca 0.07 -0.98 -0.00 0.00 0.00 0.00 0.00 60.65 59.74 1ce8 s ILE 778 Cb -0.05 -2.99 -0.02 0.00 0.01 0.00 0.00 42.46 39.40 1ce8 s ILE 778 CO -0.16 -0.03 -0.09 -0.04 0.00 0.00 0.00 174.94 174.62 1ce8 s MET 779 N 1.42 3.14 -0.25 2.79 -1.94 0.12 -4.08 119.30 120.50 1ce8 s MET 779 Ca -0.00 -0.61 -0.09 0.00 -1.71 0.00 0.00 55.69 53.28 1ce8 s MET 779 Cb -0.18 -2.65 -0.04 0.00 2.01 0.00 0.00 34.83 33.96 1ce8 s MET 779 CO 0.02 0.41 0.13 -2.00 -0.01 0.00 0.00 175.02 173.56 1ce8 s GLU 780 N -0.14 3.87 0.09 2.03 2.12 -0.53 -1.29 118.70 124.86 1ce8 s GLU 780 Ca 0.01 -0.37 -0.30 0.00 0.36 0.00 0.00 54.97 54.67 1ce8 s GLU 780 Cb -0.13 -3.46 -0.06 0.00 0.26 0.00 0.00 34.13 30.73 1ce8 s GLU 780 CO 0.03 -0.08 1.14 -1.01 -0.54 0.00 0.00 175.26 174.80 1ce8 s HIS 781 N 1.40 3.51 -0.01 5.30 3.76 -0.50 0.60 115.29 129.35 1ce8 s HIS 781 Ca 0.06 1.44 -0.22 0.00 -0.15 0.00 0.00 55.06 56.19 1ce8 s HIS 781 Cb -0.15 -3.34 -0.14 0.00 1.11 0.00 0.00 32.58 30.06 1ce8 s HIS 781 CO 0.06 -0.92 1.00 0.82 -0.85 0.00 0.00 174.74 174.85 1ce8 h ILE 782 N 4.29 0.45 -3.91 0.60 5.03 -1.03 -3.42 117.51 119.51 1ce8 h ILE 782 Ca -0.42 -0.66 -0.52 0.00 -0.12 0.00 0.00 64.86 63.14 1ce8 h ILE 782 Cb 1.21 0.68 0.07 0.00 -3.03 0.00 0.00 36.82 35.75 1ce8 h ILE 782 CO 0.78 0.09 0.59 -1.61 -0.68 0.00 0.00 178.15 177.32 1ce8 s GLU 783 N -4.10 4.19 1.01 2.37 8.01 -1.26 -4.67 118.70 124.25 1ce8 s GLU 783 Ca -0.12 2.10 -0.12 0.00 0.01 0.00 0.00 54.97 56.83 1ce8 s GLU 783 Cb 0.01 -2.90 0.19 0.00 -4.31 0.00 0.00 34.13 27.12 1ce8 s GLU 783 CO 0.44 -0.28 1.08 1.14 0.01 0.00 0.00 175.26 177.65 1ce8 s GLN 784 N -2.01 0.34 0.18 1.61 0.00 -1.26 -4.39 119.66 114.12 1ce8 s GLN 784 Ca 0.53 0.68 -0.32 0.00 -0.00 0.00 0.00 55.36 56.25 1ce8 s GLN 784 Cb -0.37 -1.71 -0.12 0.00 0.00 0.00 0.00 33.01 30.81 1ce8 s GLN 784 CO 0.48 -2.84 1.73 0.00 0.00 0.00 0.00 175.29 174.66 1ce8 n ALA 785 N -4.27 2.44 0.00 2.60 0.00 -1.09 -1.99 120.51 118.19 1ce8 n ALA 785 Ca 0.05 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.88 1ce8 n ALA 785 Cb 0.56 -2.51 0.00 0.00 0.00 0.00 0.00 19.45 17.50 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 3.94 1.18 3.59 0.00 0.00 -1.26 -4.77 105.19 107.87 1ce8 n GLY 786 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.69 5.20 0.28 1.61 1.01 -0.84 -0.35 120.40 126.63 1ce8 s VAL 787 Ca 0.00 0.13 -0.29 0.00 0.00 0.00 0.00 61.98 61.83 1ce8 s VAL 787 Cb 0.00 -3.46 -0.14 0.00 0.00 0.00 0.00 36.38 32.78 1ce8 s VAL 787 CO 0.00 0.28 1.10 1.57 0.00 0.00 0.00 175.10 178.06 1ce8 n HIS 788 N 4.85 1.52 -0.28 5.22 -0.00 0.17 -4.80 115.22 121.91 1ce8 n HIS 788 Ca -0.14 0.65 0.17 0.00 0.46 0.00 0.00 57.72 58.86 1ce8 n HIS 788 Cb 0.52 -2.30 0.44 0.00 -0.12 0.00 0.00 29.99 28.53 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 2.38 0.54 0.51 0.26 4.64 -1.91 0.11 113.55 120.08 1ce8 h SER 789 Ca -0.41 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1ce8 h SER 789 Cb 1.33 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1ce8 h SER 789 CO 0.63 0.22 0.00 1.23 -0.87 0.00 0.00 176.83 178.04 1ce8 h GLY 790 N 0.54 0.00 -1.05 -0.77 0.00 -1.97 -2.15 103.07 97.67 1ce8 h GLY 790 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.83 1ce8 h GLY 790 CO -0.23 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.53 1ce8 n ASP 791 N -2.70 2.33 -4.81 0.19 8.00 0.33 -4.68 116.55 115.22 1ce8 n ASP 791 Ca -0.00 -1.68 -0.38 0.00 0.71 0.00 0.00 54.79 53.44 1ce8 n ASP 791 Cb 0.18 -0.09 -0.06 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 -0.96 7.08 0.52 -2.24 0.01 -0.81 -4.77 113.70 112.53 1ce8 s SER 792 Ca 0.17 1.29 -0.17 0.00 1.31 0.00 0.00 55.95 58.55 1ce8 s SER 792 Cb 0.10 -2.37 -0.07 0.00 0.21 0.00 0.00 66.02 63.89 1ce8 s SER 792 CO 0.15 0.25 1.00 0.00 0.41 0.00 0.00 173.24 175.04 1ce8 s ALA 793 N -1.16 2.97 0.08 1.44 0.00 -1.26 -4.68 121.76 119.15 1ce8 s ALA 793 Ca 0.31 0.30 -0.08 0.00 0.00 0.00 0.00 51.96 52.49 1ce8 s ALA 793 Cb -0.19 -3.16 -0.00 0.00 0.00 0.00 0.00 23.12 19.76 1ce8 s ALA 793 CO 0.20 -0.32 0.17 0.00 0.00 0.00 0.00 175.76 175.81 1ce8 s SER 795 N -2.72 1.83 -0.14 0.00 0.15 0.20 -0.35 113.70 112.67 1ce8 s SER 795 Ca 0.03 -0.29 -0.01 0.00 0.70 0.00 0.00 55.95 56.38 1ce8 s SER 795 Cb 0.04 -0.45 0.04 0.00 -1.71 0.00 0.00 66.02 63.94 1ce8 s SER 795 CO -0.10 0.13 -0.02 -0.22 1.20 0.00 0.00 173.24 174.23 1ce8 s LEU 796 N 0.02 1.18 0.93 3.45 0.20 -0.14 -1.45 118.68 122.86 1ce8 s LEU 796 Ca -0.02 -0.49 -0.14 0.00 0.69 0.00 0.00 54.13 54.17 1ce8 s LEU 796 Cb -0.10 -0.71 0.15 0.00 -0.43 0.00 0.00 46.19 45.11 1ce8 s LEU 796 CO 0.01 -0.20 1.20 -2.16 -0.29 0.00 0.00 176.35 174.91 1ce8 s PRO 797 N 1.78 1.00 0.42 0.98 0.04 -1.26 -1.12 135.00 136.84 1ce8 s PRO 797 Ca 0.02 -0.00 -0.24 0.00 0.04 0.00 0.00 61.00 60.82 1ce8 s PRO 797 Cb -0.14 -1.85 -0.11 0.00 0.04 0.00 0.00 34.50 32.44 1ce8 s PRO 797 CO -0.07 -2.24 0.87 0.00 0.04 0.00 0.00 177.00 175.60 1ce8 n ALA 798 N -3.73 -0.37 0.61 8.56 0.00 -1.18 -4.81 120.51 119.58 1ce8 n ALA 798 Ca 0.10 0.21 0.06 0.00 0.00 0.00 0.00 53.44 53.82 1ce8 n ALA 798 Cb 0.60 -1.98 -0.05 0.00 0.00 0.00 0.00 19.45 18.02 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 -0.62 0.00 0.00 0.00 4.11 -1.26 -4.74 117.16 114.65 1ce8 n TYR 799 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 58.00 1ce8 n TYR 799 Cb 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.73 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 -0.90 0.00 -1.65 -3.48 -2.24 -1.26 -5.09 114.28 99.65 1ce8 n THR 800 Ca 0.04 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.39 1ce8 n THR 800 Cb 0.23 -0.25 -0.00 0.00 -2.10 0.00 0.00 70.33 68.21 1ce8 n THR 800 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1ce8 n LEU 801 N -1.79 2.98 -4.83 3.22 4.77 -1.26 -4.95 117.00 115.14 1ce8 n LEU 801 Ca 0.00 1.16 -0.31 0.00 -0.03 0.00 0.00 56.01 56.83 1ce8 n LEU 801 Cb 0.21 -1.41 0.04 0.00 -2.33 0.00 0.00 43.42 39.94 1ce8 n LEU 801 CO 0.00 -0.92 0.71 -0.94 -1.33 0.00 0.00 177.39 174.92 1ce8 s SER 802 N -0.47 5.52 0.10 -1.43 1.04 -1.26 -4.91 113.70 112.29 1ce8 s SER 802 Ca 0.58 1.59 -0.18 0.00 0.48 0.00 0.00 55.95 58.42 1ce8 s SER 802 Cb -0.59 -2.49 -0.06 0.00 0.10 0.00 0.00 66.02 62.97 1ce8 s SER 802 CO 0.60 -1.35 1.61 -0.61 0.98 0.00 0.00 173.24 174.47 1ce8 h GLN 803 N -0.62 0.44 -0.38 4.02 5.75 -1.98 -0.98 115.11 121.36 1ce8 h GLN 803 Ca -0.44 -0.10 0.07 0.00 -0.15 0.00 0.00 58.65 58.03 1ce8 h GLN 803 Cb 1.21 -0.06 -0.09 0.00 1.07 0.00 0.00 27.48 29.61 1ce8 h GLN 803 CO 0.58 0.51 -0.37 1.49 -2.65 0.00 0.00 178.83 178.39 1ce8 h GLU 804 N 0.29 -0.29 -0.60 1.69 4.81 -1.99 0.35 114.58 118.84 1ce8 h GLU 804 Ca 0.09 0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.31 1ce8 h GLU 804 Cb 0.26 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.68 1ce8 h GLU 804 CO -0.00 -0.19 0.26 0.82 -0.73 0.00 0.00 179.01 179.17 1ce8 h ILE 805 N -0.30 1.20 -0.02 2.32 1.08 -1.91 -1.13 117.51 118.75 1ce8 h ILE 805 Ca 0.15 -0.61 -0.07 0.00 -0.39 0.00 0.00 64.86 63.94 1ce8 h ILE 805 Cb 0.56 0.47 -0.01 0.00 -3.07 0.00 0.00 36.82 34.77 1ce8 h ILE 805 CO -0.54 0.25 -0.32 1.56 -0.69 0.00 0.00 178.15 178.41 1ce8 h GLN 806 N 0.85 0.04 -0.00 2.37 4.20 0.26 -2.98 115.11 119.84 1ce8 h GLN 806 Ca 0.21 -0.01 -0.12 0.00 0.06 0.00 0.00 58.65 58.78 1ce8 h GLN 806 Cb 0.13 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.89 1ce8 h GLN 806 CO -0.02 0.36 -0.57 -0.44 -0.67 0.00 0.00 178.83 177.48 1ce8 h ASP 807 N 0.03 0.02 -0.40 1.46 3.32 0.92 -2.40 116.42 119.37 1ce8 h ASP 807 Ca 0.00 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.92 1ce8 h ASP 807 Cb 0.59 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 1ce8 h ASP 807 CO 0.04 0.59 -0.23 0.58 -1.72 0.00 0.00 179.24 178.50 1ce8 h VAL 808 N 0.01 1.28 0.13 -1.35 2.07 -1.35 -0.53 116.25 116.52 1ce8 h VAL 808 Ca -0.01 -1.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.13 1ce8 h VAL 808 Cb 1.02 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 32.09 1ce8 h VAL 808 CO 0.08 0.46 -0.06 0.24 0.02 0.00 0.00 177.57 178.30 1ce8 h MET 809 N 0.66 -0.17 -0.81 1.57 2.86 -1.45 0.79 114.93 118.38 1ce8 h MET 809 Ca 0.08 0.01 0.17 0.00 -2.06 0.00 0.00 59.70 57.91 1ce8 h MET 809 Cb 0.79 0.04 -0.11 0.00 0.06 0.00 0.00 31.60 32.38 1ce8 h MET 809 CO 0.06 0.03 0.33 0.00 1.06 0.00 0.00 176.91 178.40 1ce8 h ARG 810 N -0.35 0.42 -0.43 1.72 3.08 -1.38 0.72 114.38 118.16 1ce8 h ARG 810 Ca -0.02 -0.03 -0.13 0.00 0.07 0.00 0.00 59.98 59.88 1ce8 h ARG 810 Cb 0.28 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 1ce8 h ARG 810 CO 0.03 0.28 -0.25 1.96 -1.07 0.00 0.00 179.97 180.92 1ce8 h GLN 811 N 0.43 0.89 -0.23 0.04 4.20 -0.30 -2.05 115.11 118.10 1ce8 h GLN 811 Ca 0.47 -0.39 -0.11 0.00 0.06 0.00 0.00 58.65 58.68 1ce8 h GLN 811 Cb 0.78 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.52 1ce8 h GLN 811 CO -0.45 1.04 -0.32 1.96 -0.67 0.00 0.00 178.83 180.39 1ce8 h GLN 812 N 0.77 0.47 -0.18 1.46 4.20 0.41 -2.76 115.11 119.48 1ce8 h GLN 812 Ca 0.10 -0.20 -0.00 0.00 0.06 0.00 0.00 58.65 58.60 1ce8 h GLN 812 Cb 0.80 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.56 1ce8 h GLN 812 CO 0.07 0.74 0.10 0.28 -0.67 0.00 0.00 178.83 179.35 1ce8 h VAL 813 N 0.41 1.09 -0.69 -0.54 2.07 0.51 -1.72 116.25 117.38 1ce8 h VAL 813 Ca 0.05 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.35 1ce8 h VAL 813 Cb 0.76 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 1ce8 h VAL 813 CO 0.06 0.08 0.45 -0.61 0.02 0.00 0.00 177.57 177.57 1ce8 h GLN 814 N 0.20 0.91 -0.66 1.57 4.15 -1.31 0.16 115.11 120.14 1ce8 h GLN 814 Ca 0.06 -0.06 -0.06 0.00 0.77 0.00 0.00 58.65 59.37 1ce8 h GLN 814 Cb 0.04 -0.20 -0.03 0.00 0.21 0.00 0.00 27.48 27.50 1ce8 h GLN 814 CO -0.01 0.61 0.20 0.87 -1.93 0.00 0.00 178.83 178.57 1ce8 h LYS 815 N 0.94 1.04 -0.22 1.69 6.56 -1.20 -2.67 116.57 122.69 1ce8 h LYS 815 Ca 0.25 -0.23 -0.05 0.00 -1.06 0.00 0.00 60.65 59.56 1ce8 h LYS 815 Cb -0.09 -0.15 -0.01 0.00 -0.57 0.00 0.00 32.23 31.41 1ce8 h LYS 815 CO -0.05 0.91 -0.06 -0.07 -2.06 0.00 0.00 179.45 178.11 1ce8 h LEU 816 N 0.97 0.44 -0.56 2.94 3.38 -0.98 -1.56 115.31 119.94 1ce8 h LEU 816 Ca 0.21 -0.38 0.11 0.00 0.09 0.00 0.00 57.88 57.91 1ce8 h LEU 816 Cb 0.31 -0.12 -0.11 0.00 0.09 0.00 0.00 40.66 40.83 1ce8 h LEU 816 CO -0.00 0.72 -0.27 0.00 0.09 0.00 0.00 178.44 178.98 1ce8 h ALA 817 N 0.74 0.10 0.24 1.53 0.00 -0.49 0.47 119.26 121.85 1ce8 h ALA 817 Ca 0.05 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1ce8 h ALA 817 Cb 0.53 0.65 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1ce8 h ALA 817 CO 0.02 -0.59 -0.11 0.74 0.00 0.00 0.00 179.25 179.31 1ce8 h PHE 818 N -0.13 -0.30 -0.80 0.00 0.04 -1.51 0.80 116.94 115.05 1ce8 h PHE 818 Ca 0.24 -0.01 0.08 0.00 2.80 0.00 0.00 57.97 61.09 1ce8 h PHE 818 Cb 0.52 0.10 -0.05 0.00 2.20 0.00 0.00 35.95 38.71 1ce8 h PHE 818 CO -0.57 0.01 0.52 1.49 -0.60 0.00 0.00 178.31 179.17 1ce8 h GLU 819 N -0.61 0.78 0.00 1.51 4.57 -0.79 -2.18 114.58 117.86 1ce8 h GLU 819 Ca -0.03 -0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 58.07 1ce8 h GLU 819 Cb 0.44 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 28.85 1ce8 h GLU 819 CO 0.05 0.51 -0.36 -0.07 -1.18 0.00 0.00 179.01 177.96 1ce8 h LEU 820 N 0.80 0.00 -1.64 1.64 3.38 -0.09 -3.48 115.31 115.93 1ce8 h LEU 820 Ca 0.36 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.29 1ce8 h LEU 820 Cb 0.34 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.10 1ce8 h LEU 820 CO -0.13 0.14 -0.07 0.00 0.09 0.00 0.00 178.44 178.47 1ce8 n GLN 821 N -3.04 -0.65 -1.99 1.13 6.02 -0.82 -4.70 117.38 113.33 1ce8 n GLN 821 Ca 0.02 0.08 -0.39 0.00 -0.01 0.00 0.00 57.00 56.70 1ce8 n GLN 821 Cb 0.59 -2.81 0.01 0.00 1.02 0.00 0.00 30.24 29.05 1ce8 n GLN 821 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1ce8 s VAL 822 N -3.03 2.49 -0.42 5.09 1.01 0.22 -4.64 120.40 121.12 1ce8 s VAL 822 Ca 0.02 0.42 0.04 0.00 0.00 0.00 0.00 61.98 62.46 1ce8 s VAL 822 Cb -0.01 -3.24 0.17 0.00 0.00 0.00 0.00 36.38 33.30 1ce8 s VAL 822 CO 0.07 0.04 0.40 -0.13 0.00 0.00 0.00 175.10 175.48 1ce8 s ARG 823 N -2.44 0.88 0.00 2.72 1.81 -1.24 -3.97 118.95 116.71 1ce8 s ARG 823 Ca 0.61 -1.79 0.00 0.00 -1.72 0.00 0.00 55.73 52.83 1ce8 s ARG 823 Cb -0.38 -1.13 0.00 0.00 -0.45 0.00 0.00 34.95 32.99 1ce8 s ARG 823 CO 0.48 -1.35 0.00 0.41 -0.68 0.00 0.00 175.30 174.16 1ce8 n GLY 824 N 3.05 0.36 3.81 -3.53 0.00 -0.57 -1.43 105.19 106.88 1ce8 n GLY 824 Ca 0.25 -1.91 -0.32 0.00 0.00 0.00 0.00 46.02 44.05 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 3.40 0.16 0.99 1.43 -1.26 -2.17 118.68 121.23 1ce8 s LEU 825 Ca 0.00 1.73 -0.18 0.00 -1.03 0.00 0.00 54.13 54.65 1ce8 s LEU 825 Cb 0.00 -4.52 0.04 0.00 0.03 0.00 0.00 46.19 41.74 1ce8 s LEU 825 CO 0.00 -1.19 0.50 0.00 0.23 0.00 0.00 176.35 175.89 1ce8 s MET 826 N -4.37 1.25 -0.07 1.70 0.23 -0.21 -2.45 119.30 115.39 1ce8 s MET 826 Ca 0.61 -0.72 -0.05 0.00 -1.03 0.00 0.00 55.69 54.50 1ce8 s MET 826 Cb -0.15 0.52 0.03 0.00 -1.53 0.00 0.00 34.83 33.70 1ce8 s MET 826 CO 0.42 -0.52 0.17 1.21 -2.03 0.00 0.00 175.02 174.26 1ce8 s ASN 827 N -2.82 -0.17 -0.05 -1.18 3.84 0.18 -1.61 114.94 113.14 1ce8 s ASN 827 Ca 0.05 0.35 0.05 0.00 0.21 0.00 0.00 52.86 53.52 1ce8 s ASN 827 Cb -0.00 0.30 -0.00 0.00 -0.55 0.00 0.00 41.25 41.00 1ce8 s ASN 827 CO -0.08 -0.10 -0.19 -0.69 -2.79 0.00 0.00 177.10 173.26 1ce8 s VAL 828 N 0.53 1.55 -0.18 -5.21 1.01 0.43 0.20 120.40 118.73 1ce8 s VAL 828 Ca -0.04 -0.79 -0.03 0.00 0.00 0.00 0.00 61.98 61.13 1ce8 s VAL 828 Cb -0.05 -1.33 -0.02 0.00 0.00 0.00 0.00 36.38 34.98 1ce8 s VAL 828 CO -0.03 0.44 -0.06 -1.10 0.00 0.00 0.00 175.10 174.36 1ce8 s GLN 829 N -0.02 3.46 0.28 2.72 -0.21 0.30 -0.44 119.66 125.76 1ce8 s GLN 829 Ca -0.03 -0.61 0.12 0.00 0.02 0.00 0.00 55.36 54.85 1ce8 s GLN 829 Cb -0.12 -2.90 -0.05 0.00 1.00 0.00 0.00 33.01 30.95 1ce8 s GLN 829 CO 0.02 0.02 -0.18 -0.06 -2.12 0.00 0.00 175.29 172.97 1ce8 s PHE 830 N 0.90 2.33 -0.08 0.91 0.08 0.60 -0.64 117.98 122.09 1ce8 s PHE 830 Ca -0.01 -0.32 0.02 0.00 0.12 0.00 0.00 56.93 56.74 1ce8 s PHE 830 Cb -0.15 -1.01 0.01 0.00 -0.57 0.00 0.00 43.02 41.31 1ce8 s PHE 830 CO 0.01 0.71 -0.12 0.00 -0.10 0.00 0.00 175.22 175.71 1ce8 s ALA 831 N -2.48 1.32 -0.40 5.36 0.00 -0.64 0.08 121.76 125.01 1ce8 s ALA 831 Ca 0.30 -0.47 -0.06 0.00 0.00 0.00 0.00 51.96 51.73 1ce8 s ALA 831 Cb -0.05 -0.64 0.09 0.00 0.00 0.00 0.00 23.12 22.52 1ce8 s ALA 831 CO 0.15 0.03 0.20 0.08 0.00 0.00 0.00 175.76 176.23 1ce8 s VAL 832 N 0.82 3.72 -0.22 0.00 1.01 0.47 -0.20 120.40 125.99 1ce8 s VAL 832 Ca -0.12 -1.63 0.02 0.00 0.00 0.00 0.00 61.98 60.25 1ce8 s VAL 832 Cb -0.15 -3.35 0.04 0.00 0.00 0.00 0.00 36.38 32.91 1ce8 s VAL 832 CO 0.02 -0.52 -0.16 -0.75 0.00 0.00 0.00 175.10 173.69 1ce8 s LYS 833 N 1.30 2.62 -1.12 2.72 2.20 -0.50 -2.25 119.74 124.71 1ce8 s LYS 833 Ca 0.04 -1.07 -0.00 0.00 -0.36 0.00 0.00 55.97 54.57 1ce8 s LYS 833 Cb -0.23 -2.71 -0.00 0.00 -1.51 0.00 0.00 37.83 33.38 1ce8 s LYS 833 CO -0.01 -0.38 0.93 0.09 -0.36 0.00 0.00 175.35 175.62 1ce8 n ASN 834 N 4.53 -2.07 0.00 1.43 5.03 -1.26 -2.15 115.26 120.78 1ce8 n ASN 834 Ca -0.18 -0.58 0.00 0.00 0.87 0.00 0.00 54.58 54.70 1ce8 n ASN 834 Cb 0.46 -4.82 0.00 0.00 -1.02 0.00 0.00 39.78 34.40 1ce8 n ASN 834 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1ce8 n ASN 835 N -2.99 -2.18 -4.75 6.41 4.05 -1.26 -4.94 115.26 109.60 1ce8 n ASN 835 Ca -0.27 0.00 -0.35 0.00 0.45 0.00 0.00 54.58 54.41 1ce8 n ASN 835 Cb 0.66 -2.70 -0.08 0.00 1.23 0.00 0.00 39.78 38.88 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 -1.29 3.11 -0.21 1.20 2.02 -0.91 -5.02 118.70 117.60 1ce8 s GLU 836 Ca 0.00 -0.34 -0.08 0.00 0.02 0.00 0.00 54.97 54.56 1ce8 s GLU 836 Cb 0.00 -2.90 -0.04 0.00 0.10 0.00 0.00 34.13 31.29 1ce8 s GLU 836 CO 0.00 0.72 0.09 0.08 0.02 0.00 0.00 175.26 176.17 1ce8 s VAL 837 N -0.96 4.84 0.13 2.63 1.01 -1.26 -1.41 120.40 125.38 1ce8 s VAL 837 Ca 0.15 -0.01 0.08 0.00 0.00 0.00 0.00 61.98 62.20 1ce8 s VAL 837 Cb -0.12 -3.22 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 1ce8 s VAL 837 CO 0.04 0.40 -0.11 -0.31 0.00 0.00 0.00 175.10 175.12 1ce8 s TYR 838 N 0.84 2.67 -0.31 5.22 1.51 0.71 -4.47 117.35 123.53 1ce8 s TYR 838 Ca 0.05 -0.20 -0.16 0.00 -1.01 0.00 0.00 57.07 55.75 1ce8 s TYR 838 Cb -0.13 -1.37 -0.02 0.00 -0.11 0.00 0.00 41.96 40.33 1ce8 s TYR 838 CO 0.02 0.45 0.43 -1.17 -1.11 0.00 0.00 175.55 174.17 1ce8 s LEU 839 N -2.42 4.23 -0.13 -1.29 2.96 0.37 -1.62 118.68 120.77 1ce8 s LEU 839 Ca 0.22 0.09 -0.13 0.00 -0.22 0.00 0.00 54.13 54.10 1ce8 s LEU 839 Cb -0.10 -2.48 -0.10 0.00 0.50 0.00 0.00 46.19 44.01 1ce8 s LEU 839 CO 0.14 -0.32 0.20 0.40 -1.32 0.00 0.00 176.35 175.45 1ce8 h ILE 840 N 5.49 0.61 -1.98 6.68 2.04 -1.17 -3.40 117.51 125.78 1ce8 h ILE 840 Ca -0.30 -1.52 0.20 0.00 1.00 0.00 0.00 64.86 64.24 1ce8 h ILE 840 Cb 1.14 1.22 -0.13 0.00 -0.74 0.00 0.00 36.82 38.31 1ce8 h ILE 840 CO 0.70 0.21 0.62 -1.83 0.00 0.00 0.00 178.15 177.85 1ce8 s GLU 841 N -1.97 0.75 -0.07 2.37 -1.05 -1.15 -5.01 118.70 112.56 1ce8 s GLU 841 Ca -0.12 -0.36 0.05 0.00 -0.15 0.00 0.00 54.97 54.40 1ce8 s GLU 841 Cb 0.00 0.29 -0.01 0.00 -0.44 0.00 0.00 34.13 33.98 1ce8 s GLU 841 CO 0.31 -0.34 -0.24 0.08 0.95 0.00 0.00 175.26 176.02 1ce8 s VAL 842 N -2.90 2.11 -0.48 1.83 1.01 -1.26 -0.54 120.40 120.18 1ce8 s VAL 842 Ca 0.10 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 61.08 1ce8 s VAL 842 Cb 0.00 -1.78 0.13 0.00 0.00 0.00 0.00 36.38 34.73 1ce8 s VAL 842 CO -0.04 0.57 0.24 0.20 0.00 0.00 0.00 175.10 176.07 1ce8 s ASN 843 N -0.01 4.02 0.00 3.32 0.01 0.54 -4.70 114.94 118.13 1ce8 s ASN 843 Ca -0.08 -2.81 -0.00 0.00 -0.71 0.00 0.00 52.86 49.25 1ce8 s ASN 843 Cb -0.15 -1.36 -0.01 0.00 0.41 0.00 0.00 41.25 40.14 1ce8 s ASN 843 CO 0.05 -0.25 0.57 -0.81 -1.51 0.00 0.00 177.10 175.15 1ce8 n PRO 844 N 3.34 0.26 -1.70 -0.60 -0.04 -1.26 0.49 135.00 135.49 1ce8 n PRO 844 Ca 0.06 -0.04 -0.02 0.00 -0.04 0.00 0.00 63.50 63.47 1ce8 n PRO 844 Cb 0.33 -1.43 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 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 2.05 0.17 -2.59 0.54 1.85 -1.02 -4.72 116.66 112.93 1ce8 n ARG 845 Ca 0.02 -0.44 -0.42 0.00 -1.00 0.00 0.00 57.85 56.01 1ce8 n ARG 845 Cb 0.13 0.48 -0.03 0.00 -1.05 0.00 0.00 32.46 31.98 1ce8 n ARG 845 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1ce8 s ALA 846 N -1.44 3.28 0.34 2.89 0.00 -1.12 -2.95 121.76 122.75 1ce8 s ALA 846 Ca 0.04 0.68 0.05 0.00 0.00 0.00 0.00 51.96 52.74 1ce8 s ALA 846 Cb -0.01 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.74 1ce8 s ALA 846 CO 0.03 -0.25 0.48 0.00 0.00 0.00 0.00 175.76 176.02 1ce8 s ALA 847 N 0.64 4.12 -1.15 0.00 0.00 -1.26 -4.86 121.76 119.25 1ce8 s ALA 847 Ca 0.53 -1.36 0.12 0.00 0.00 0.00 0.00 51.96 51.24 1ce8 s ALA 847 Cb -0.25 -1.76 0.53 0.00 0.00 0.00 0.00 23.12 21.64 1ce8 s ALA 847 CO 0.30 -0.04 1.35 2.89 0.00 0.00 0.00 175.76 180.26 1ce8 n ARG 848 N -1.67 0.06 0.01 0.00 1.85 -1.26 -1.51 116.66 114.14 1ce8 n ARG 848 Ca -0.01 0.26 0.13 0.00 -1.00 0.00 0.00 57.85 57.22 1ce8 n ARG 848 Cb 0.58 -1.50 0.36 0.00 -1.05 0.00 0.00 32.46 30.85 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 -1.43 0.09 -0.14 8.89 -2.24 -1.26 -4.33 114.28 113.86 1ce8 n THR 849 Ca 0.04 -0.06 -0.04 0.00 -2.27 0.00 0.00 64.05 61.72 1ce8 n THR 849 Cb 0.12 -0.08 0.04 0.00 -2.10 0.00 0.00 70.33 68.31 1ce8 n THR 849 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1ce8 h VAL 850 N 0.00 0.81 -0.75 2.28 2.07 -1.64 -1.10 116.25 117.93 1ce8 h VAL 850 Ca 0.00 -0.09 -0.04 0.00 0.82 0.00 0.00 66.70 67.39 1ce8 h VAL 850 Cb 0.55 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1ce8 h VAL 850 CO 0.00 0.05 0.32 -0.65 0.02 0.00 0.00 177.57 177.31 1ce8 h PRO 851 N 0.27 1.10 0.17 1.57 0.11 -1.81 -0.61 132.00 132.79 1ce8 h PRO 851 Ca 0.21 -0.18 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1ce8 h PRO 851 Cb 0.24 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 1ce8 h PRO 851 CO -0.25 0.87 -0.14 0.35 -0.21 0.00 0.00 178.00 178.63 1ce8 h PHE 852 N 1.08 -0.37 -0.92 0.65 3.57 -1.67 -0.83 116.94 118.45 1ce8 h PHE 852 Ca 0.25 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.77 1ce8 h PHE 852 Cb 0.17 0.14 -0.05 0.00 2.79 0.00 0.00 35.95 39.01 1ce8 h PHE 852 CO 0.02 -0.22 0.60 0.28 -2.23 0.00 0.00 178.31 176.76 1ce8 h VAL 853 N -0.33 1.20 -0.48 1.41 2.07 -1.01 -0.12 116.25 119.00 1ce8 h VAL 853 Ca -0.00 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.06 1ce8 h VAL 853 Cb 0.30 -0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 29.94 1ce8 h VAL 853 CO -0.02 0.22 0.11 0.28 0.02 0.00 0.00 177.57 178.18 1ce8 h SER 854 N 1.21 0.67 0.55 0.57 0.02 -0.77 0.12 113.55 115.92 1ce8 h SER 854 Ca 0.35 -0.11 -0.19 0.00 -0.84 0.00 0.00 61.79 61.00 1ce8 h SER 854 Cb -0.09 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 1ce8 h SER 854 CO -0.09 0.66 -0.84 0.11 -1.14 0.00 0.00 176.83 175.53 1ce8 h LYS 855 N 0.70 0.20 0.01 3.45 6.56 -0.33 -1.39 116.57 125.78 1ce8 h LYS 855 Ca 0.16 -0.21 -0.08 0.00 -1.06 0.00 0.00 60.65 59.46 1ce8 h LYS 855 Cb 0.27 0.06 0.01 0.00 -0.57 0.00 0.00 32.23 31.99 1ce8 h LYS 855 CO -0.00 0.93 -0.30 0.00 -2.06 0.00 0.00 179.45 178.02 1ce8 h ALA 856 N 1.00 0.02 0.00 3.86 0.00 -0.43 -3.34 119.26 120.37 1ce8 h ALA 856 Ca -0.04 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1ce8 h ALA 856 Cb 1.46 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1ce8 h ALA 856 CO 0.13 0.12 -0.03 1.79 0.00 0.00 0.00 179.25 181.26 1ce8 h THR 857 N -0.50 0.00 0.00 0.00 1.35 -0.87 -3.46 112.91 109.43 1ce8 h THR 857 Ca -0.04 -0.71 0.00 0.00 -0.55 0.00 0.00 66.41 65.11 1ce8 h THR 857 Cb 1.08 1.69 0.00 0.00 -1.73 0.00 0.00 68.15 69.19 1ce8 h THR 857 CO 0.06 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.94 1ce8 n GLY 858 N 1.22 2.50 3.74 5.82 0.00 -0.53 -4.94 105.19 113.01 1ce8 n GLY 858 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.22 5.02 -1.22 1.61 1.01 -1.22 -4.98 120.40 118.39 1ce8 s VAL 859 Ca 0.00 1.19 -0.09 0.00 0.00 0.00 0.00 61.98 63.08 1ce8 s VAL 859 Cb 0.00 -3.91 0.20 0.00 0.00 0.00 0.00 36.38 32.67 1ce8 s VAL 859 CO 0.00 0.36 1.68 -0.81 0.00 0.00 0.00 175.10 176.34 1ce8 n PRO 860 N 3.17 3.76 -0.33 2.72 -0.04 -1.26 -4.05 135.00 138.97 1ce8 n PRO 860 Ca -0.06 -3.85 0.14 0.00 -0.04 0.00 0.00 63.50 59.69 1ce8 n PRO 860 Cb 0.51 -2.84 0.28 0.00 -0.04 0.00 0.00 33.50 31.41 1ce8 n PRO 860 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1ce8 h LEU 861 N 7.59 -0.44 -0.68 1.53 3.38 -1.93 0.13 115.31 124.89 1ce8 h LEU 861 Ca 0.33 0.27 0.06 0.00 0.09 0.00 0.00 57.88 58.63 1ce8 h LEU 861 Cb 0.68 0.46 -0.06 0.00 0.09 0.00 0.00 40.66 41.83 1ce8 h LEU 861 CO 1.47 -0.33 0.38 0.00 0.09 0.00 0.00 178.44 180.06 1ce8 h ALA 862 N 1.95 0.92 0.07 1.53 0.00 -1.92 1.15 119.26 122.95 1ce8 h ALA 862 Ca 0.58 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.50 1ce8 h ALA 862 Cb 1.18 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1ce8 h ALA 862 CO -0.89 0.07 -0.03 0.87 0.00 0.00 0.00 179.25 179.27 1ce8 h LYS 863 N 0.71 -0.09 0.69 0.00 1.57 -1.07 -0.36 116.57 118.01 1ce8 h LYS 863 Ca 0.30 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 59.06 1ce8 h LYS 863 Cb 0.18 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 1ce8 h LYS 863 CO -0.18 0.11 -0.45 0.28 -0.57 0.00 0.00 179.45 178.65 1ce8 h VAL 864 N -0.28 0.00 -0.12 0.50 2.07 -0.52 -1.32 116.25 116.58 1ce8 h VAL 864 Ca -0.01 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 1ce8 h VAL 864 Cb 0.24 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.01 1ce8 h VAL 864 CO 0.02 0.00 0.11 0.00 0.02 0.00 0.00 177.57 177.72 1ce8 h ALA 865 N -1.22 1.83 -0.02 1.67 0.00 0.13 -1.27 119.26 120.38 1ce8 h ALA 865 Ca -0.09 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1ce8 h ALA 865 Cb 0.86 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 1ce8 h ALA 865 CO 0.08 -0.18 0.01 0.00 0.00 0.00 0.00 179.25 179.16 1ce8 h ALA 866 N 1.89 0.03 -0.63 0.00 0.00 -0.58 -0.35 119.26 119.62 1ce8 h ALA 866 Ca 0.06 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.87 1ce8 h ALA 866 Cb 0.28 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1ce8 h ALA 866 CO -0.00 -0.36 0.41 0.00 0.00 0.00 0.00 179.25 179.30 1ce8 h ARG 867 N -0.17 0.81 -0.74 0.00 3.08 -0.13 -1.19 114.38 116.04 1ce8 h ARG 867 Ca 0.01 -0.05 0.06 0.00 0.07 0.00 0.00 59.98 60.07 1ce8 h ARG 867 Cb 0.22 -0.18 -0.06 0.00 0.08 0.00 0.00 29.97 30.03 1ce8 h ARG 867 CO -0.00 0.53 0.43 0.28 -1.07 0.00 0.00 179.97 180.14 1ce8 h VAL 868 N 0.83 0.98 0.00 2.04 2.07 -1.15 0.28 116.25 121.30 1ce8 h VAL 868 Ca 0.23 -0.27 -0.07 0.00 0.82 0.00 0.00 66.70 67.42 1ce8 h VAL 868 Cb -0.07 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 29.82 1ce8 h VAL 868 CO -0.06 0.14 -0.35 0.24 0.02 0.00 0.00 177.57 177.56 1ce8 h MET 869 N 0.78 0.00 -0.19 1.57 2.86 -0.27 -2.33 114.93 117.35 1ce8 h MET 869 Ca 0.33 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.97 1ce8 h MET 869 Cb 0.20 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.86 1ce8 h MET 869 CO -0.19 0.35 0.00 0.00 1.06 0.00 0.00 176.91 178.13 1ce8 n ALA 870 N -2.44 2.49 0.00 6.32 0.00 -0.31 -4.10 120.51 122.47 1ce8 n ALA 870 Ca -0.02 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.17 1ce8 n ALA 870 Cb 0.39 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.85 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 0.69 0.71 3.37 0.00 0.00 -0.88 -5.03 105.19 104.05 1ce8 n GLY 871 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.91 3.23 0.78 1.61 2.20 -0.07 -4.97 119.74 121.62 1ce8 s LYS 872 Ca 0.00 -0.76 -0.12 0.00 -0.36 0.00 0.00 55.97 54.73 1ce8 s LYS 872 Cb 0.00 -3.38 0.07 0.00 -1.51 0.00 0.00 37.83 33.00 1ce8 s LYS 872 CO 0.00 -0.39 1.13 -1.54 -0.36 0.00 0.00 175.35 174.19 1ce8 s SER 873 N 1.54 4.16 0.23 1.43 1.04 -1.26 -2.79 113.70 118.05 1ce8 s SER 873 Ca 0.04 2.04 -0.07 0.00 0.48 0.00 0.00 55.95 58.44 1ce8 s SER 873 Cb -0.17 -2.55 0.29 0.00 0.10 0.00 0.00 66.02 63.69 1ce8 s SER 873 CO 0.03 -2.27 1.84 -0.07 0.98 0.00 0.00 173.24 173.75 1ce8 h LEU 874 N -0.96 0.77 0.16 2.42 3.38 -1.94 0.22 115.31 119.35 1ce8 h LEU 874 Ca -0.45 0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.55 1ce8 h LEU 874 Cb 1.25 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.84 1ce8 h LEU 874 CO 0.49 0.50 -0.19 0.00 0.09 0.00 0.00 178.44 179.33 1ce8 h ALA 875 N 1.38 -0.36 -0.84 1.53 0.00 -1.91 0.26 119.26 119.32 1ce8 h ALA 875 Ca 0.34 -0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.32 1ce8 h ALA 875 Cb 0.14 0.29 -0.08 0.00 0.00 0.00 0.00 17.79 18.14 1ce8 h ALA 875 CO -0.16 -0.73 0.46 0.93 0.00 0.00 0.00 179.25 179.75 1ce8 h GLU 876 N -0.40 0.71 -0.27 0.00 5.08 -1.68 -1.15 114.58 116.87 1ce8 h GLU 876 Ca 0.01 -0.04 -0.13 0.00 -1.00 0.00 0.00 59.36 58.20 1ce8 h GLU 876 Cb 0.39 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1ce8 h GLU 876 CO -0.07 0.47 -0.35 1.96 -1.00 0.00 0.00 179.01 180.02 1ce8 h GLN 877 N 0.73 0.60 0.00 2.33 4.20 0.00 -3.47 115.11 119.51 1ce8 h GLN 877 Ca 0.43 -0.29 0.00 0.00 0.06 0.00 0.00 58.65 58.85 1ce8 h GLN 877 Cb 0.48 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.25 1ce8 h GLN 877 CO -0.29 0.87 0.00 0.41 -0.67 0.00 0.00 178.83 179.15 1ce8 n GLY 878 N -0.10 0.99 3.04 3.46 0.00 0.86 -5.05 105.19 108.40 1ce8 n GLY 878 Ca -0.01 -0.21 -0.34 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.00 3.19 0.00 1.61 1.01 -0.83 -4.89 120.40 118.48 1ce8 s VAL 879 Ca 0.00 -2.98 0.00 0.00 0.00 0.00 0.00 61.98 59.00 1ce8 s VAL 879 Cb 0.00 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.24 1ce8 s VAL 879 CO 0.00 -0.82 0.00 0.35 0.00 0.00 0.00 175.10 174.63 1ce8 n THR 880 N 3.49 0.00 -3.85 3.92 -2.24 -1.26 -4.54 114.28 109.79 1ce8 n THR 880 Ca 0.06 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.47 1ce8 n THR 880 Cb 0.36 -0.84 -0.06 0.00 -2.10 0.00 0.00 70.33 67.69 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 -1.96 3.51 0.03 -0.78 -0.14 -1.26 -4.88 119.74 114.26 1ce8 s LYS 881 Ca 0.00 -0.10 -0.30 0.00 -1.36 0.00 0.00 55.97 54.20 1ce8 s LYS 881 Cb 0.00 -3.20 -0.06 0.00 -1.68 0.00 0.00 37.83 32.89 1ce8 s LYS 881 CO 0.00 0.75 1.35 -2.00 -0.76 0.00 0.00 175.35 174.68 1ce8 s GLU 882 N -0.96 4.32 -0.03 1.68 2.12 -1.26 -4.98 118.70 119.59 1ce8 s GLU 882 Ca 0.15 1.93 -0.25 0.00 0.36 0.00 0.00 54.97 57.17 1ce8 s GLU 882 Cb -0.12 -3.46 -0.04 0.00 0.26 0.00 0.00 34.13 30.77 1ce8 s GLU 882 CO 0.04 -0.48 0.75 0.08 -0.54 0.00 0.00 175.26 175.12 1ce8 s VAL 883 N 1.86 4.96 -0.33 3.70 1.01 -1.26 -4.99 120.40 125.34 1ce8 s VAL 883 Ca 0.62 1.57 0.01 0.00 0.00 0.00 0.00 61.98 64.19 1ce8 s VAL 883 Cb -0.32 -4.09 0.10 0.00 0.00 0.00 0.00 36.38 32.07 1ce8 s VAL 883 CO 0.27 0.26 0.09 -0.63 0.00 0.00 0.00 175.10 175.10 1ce8 s ILE 884 N 0.64 1.52 0.62 2.22 1.01 -1.26 -4.92 121.20 121.03 1ce8 s ILE 884 Ca 0.40 -1.89 -0.18 0.00 0.00 0.00 0.00 60.65 58.98 1ce8 s ILE 884 Cb -0.19 -2.13 -0.05 0.00 0.01 0.00 0.00 42.46 40.11 1ce8 s ILE 884 CO 0.20 -0.66 0.85 -0.81 0.00 0.00 0.00 174.94 174.52 1ce8 n PRO 885 N 4.50 0.73 -0.01 2.79 -0.04 -1.26 -4.91 135.00 136.79 1ce8 n PRO 885 Ca 0.01 0.29 0.12 0.00 -0.04 0.00 0.00 63.50 63.88 1ce8 n PRO 885 Cb 0.41 -2.06 0.65 0.00 -0.04 0.00 0.00 33.50 32.47 1ce8 n PRO 885 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1ce8 n PRO 886 N -0.92 1.18 -4.42 0.54 -0.04 -1.26 -4.86 135.00 125.23 1ce8 n PRO 886 Ca 0.13 -0.27 -0.22 0.00 -0.04 0.00 0.00 63.50 63.11 1ce8 n PRO 886 Cb 0.48 -1.39 -0.09 0.00 -0.04 0.00 0.00 33.50 32.46 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 -1.97 1.73 -0.14 0.54 -0.85 -1.26 -5.00 117.35 110.40 1ce8 s TYR 887 Ca 0.36 -1.27 -0.05 0.00 -0.52 0.00 0.00 57.07 55.59 1ce8 s TYR 887 Cb 0.17 -1.04 -0.04 0.00 0.38 0.00 0.00 41.96 41.44 1ce8 s TYR 887 CO 0.28 -0.35 0.03 0.71 -1.52 0.00 0.00 175.55 174.70 1ce8 s TYR 888 N -3.41 3.22 -0.09 -3.49 2.02 0.49 -4.37 117.35 111.73 1ce8 s TYR 888 Ca 0.32 0.10 0.03 0.00 -0.37 0.00 0.00 57.07 57.15 1ce8 s TYR 888 Cb 0.05 -1.95 0.01 0.00 -0.40 0.00 0.00 41.96 39.66 1ce8 s TYR 888 CO 0.16 0.29 -0.19 -1.12 -1.57 0.00 0.00 175.55 173.12 1ce8 s SER 889 N -0.19 2.59 -0.08 2.29 0.01 -0.28 -0.34 113.70 117.70 1ce8 s SER 889 Ca 0.06 -0.46 0.04 0.00 1.31 0.00 0.00 55.95 56.90 1ce8 s SER 889 Cb -0.12 -1.19 -0.00 0.00 0.21 0.00 0.00 66.02 64.92 1ce8 s SER 889 CO 0.02 0.11 -0.22 -0.69 0.41 0.00 0.00 173.24 172.86 1ce8 s VAL 890 N 0.50 1.87 -0.14 3.43 1.01 0.21 -0.97 120.40 126.31 1ce8 s VAL 890 Ca -0.17 -0.92 -0.05 0.00 0.00 0.00 0.00 61.98 60.84 1ce8 s VAL 890 Cb -0.17 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 1ce8 s VAL 890 CO 0.06 0.52 0.04 -0.75 0.00 0.00 0.00 175.10 174.97 1ce8 s LYS 891 N 0.27 3.56 0.13 2.72 2.20 0.53 -0.31 119.74 128.84 1ce8 s LYS 891 Ca -0.14 -0.36 0.06 0.00 -0.36 0.00 0.00 55.97 55.17 1ce8 s LYS 891 Cb -0.16 -3.04 -0.04 0.00 -1.51 0.00 0.00 37.83 33.07 1ce8 s LYS 891 CO 0.07 0.47 -0.13 -2.00 -0.36 0.00 0.00 175.35 173.40 1ce8 s GLU 892 N -0.21 1.04 0.45 4.03 2.56 -0.68 0.03 118.70 125.91 1ce8 s GLU 892 Ca 0.07 -1.30 0.07 0.00 0.00 0.00 0.00 54.97 53.81 1ce8 s GLU 892 Cb -0.12 -0.83 -0.02 0.00 2.00 0.00 0.00 34.13 35.16 1ce8 s GLU 892 CO 0.02 0.15 0.32 0.14 -0.56 0.00 0.00 175.26 175.33 1ce8 s VAL 893 N -2.48 2.30 -0.06 3.70 -7.23 -1.26 -0.97 120.40 114.39 1ce8 s VAL 893 Ca 0.11 -1.49 0.02 0.00 -1.81 0.00 0.00 61.98 58.82 1ce8 s VAL 893 Cb -0.03 -2.79 0.01 0.00 0.56 0.00 0.00 36.38 34.14 1ce8 s VAL 893 CO 0.03 0.00 -0.11 0.68 -0.31 0.00 0.00 175.10 175.39 1ce8 s VAL 894 N -2.59 1.04 0.08 1.32 -7.23 -0.95 -4.88 120.40 107.19 1ce8 s VAL 894 Ca 0.42 -0.42 0.06 0.00 -1.81 0.00 0.00 61.98 60.23 1ce8 s VAL 894 Cb -0.01 -0.96 -0.04 0.00 0.56 0.00 0.00 36.38 35.94 1ce8 s VAL 894 CO 0.25 0.33 -0.06 -0.76 -0.31 0.00 0.00 175.10 174.55 1ce8 s LEU 895 N 0.68 3.20 0.00 1.32 1.02 -1.26 -2.31 118.68 121.33 1ce8 s LEU 895 Ca -0.14 -0.28 0.09 0.00 0.02 0.00 0.00 54.13 53.82 1ce8 s LEU 895 Cb -0.15 -1.95 0.40 0.00 0.02 0.00 0.00 46.19 44.51 1ce8 s LEU 895 CO 0.03 0.19 1.29 -0.81 0.02 0.00 0.00 176.35 177.07 1ce8 n PRO 896 N 0.79 1.33 -0.32 1.29 -0.04 -1.26 -4.45 135.00 132.34 1ce8 n PRO 896 Ca -0.13 -0.51 0.16 0.00 -0.04 0.00 0.00 63.50 62.99 1ce8 n PRO 896 Cb 0.52 -1.19 0.36 0.00 -0.04 0.00 0.00 33.50 33.15 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 0.89 0.79 -0.11 0.54 0.04 -1.93 0.37 116.94 117.53 1ce8 h PHE 897 Ca 0.00 0.04 0.03 0.00 2.80 0.00 0.00 57.97 60.84 1ce8 h PHE 897 Cb 0.20 -0.20 -0.00 0.00 2.20 0.00 0.00 35.95 38.15 1ce8 h PHE 897 CO 0.08 -0.05 0.16 -2.95 -0.60 0.00 0.00 178.31 174.95 1ce8 h ASN 898 N 0.43 0.00 1.72 2.17 -1.07 -1.98 -0.33 115.58 116.51 1ce8 h ASN 898 Ca 0.62 0.00 -0.05 0.00 0.07 0.00 0.00 56.30 56.93 1ce8 h ASN 898 Cb 1.22 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.47 1ce8 h ASN 898 CO -0.54 0.00 -0.24 0.11 0.07 0.00 0.00 177.43 176.83 1ce8 h LYS 899 N 0.00 0.00 -2.17 4.14 1.79 -0.61 -3.38 116.57 116.35 1ce8 h LYS 899 Ca 0.05 0.00 -0.58 0.00 -2.18 0.00 0.00 60.65 57.94 1ce8 h LYS 899 Cb 0.38 0.00 -0.41 0.00 -1.58 0.00 0.00 32.23 30.62 1ce8 h LYS 899 CO -0.00 0.24 -0.82 1.19 -1.08 0.00 0.00 179.45 178.98 1ce8 n PHE 900 N -3.17 1.74 -0.34 -1.35 3.72 -0.14 -4.97 117.46 112.95 1ce8 n PHE 900 Ca 0.03 -3.88 0.26 0.00 -0.05 0.00 0.00 57.45 53.81 1ce8 n PHE 900 Cb 0.62 -0.44 0.54 0.00 -0.94 0.00 0.00 39.48 39.27 1ce8 n PHE 900 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1ce8 h PRO 901 N 4.23 0.31 0.00 -1.08 0.11 -1.73 0.16 132.00 134.00 1ce8 h PRO 901 Ca 0.15 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.24 1ce8 h PRO 901 Cb 0.77 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.81 1ce8 h PRO 901 CO 0.65 0.21 0.00 0.41 -0.21 0.00 0.00 178.00 179.06 1ce8 n GLY 902 N -1.49 -0.76 3.90 -0.55 0.00 -1.26 -4.73 105.19 100.30 1ce8 n GLY 902 Ca 0.27 -0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.75 5.03 -0.44 1.61 1.01 0.55 -4.43 120.40 120.98 1ce8 s VAL 903 Ca 0.09 0.16 -0.28 0.00 0.00 0.00 0.00 61.98 61.95 1ce8 s VAL 903 Cb 0.08 -3.68 0.03 0.00 0.00 0.00 0.00 36.38 32.80 1ce8 s VAL 903 CO 0.19 -0.18 1.06 -0.62 0.00 0.00 0.00 175.10 175.55 1ce8 s ASP 904 N -2.80 6.66 -0.67 3.32 2.15 -1.26 -4.89 116.67 119.17 1ce8 s ASP 904 Ca 0.44 0.50 -0.06 0.00 0.43 0.00 0.00 52.55 53.87 1ce8 s ASP 904 Cb -0.11 -2.52 -0.10 0.00 -0.30 0.00 0.00 42.92 39.89 1ce8 s ASP 904 CO 0.26 -1.10 2.41 -0.81 -0.17 0.00 0.00 175.17 175.76 1ce8 n PRO 905 N 7.42 2.03 -4.87 4.34 -0.04 -1.26 -4.86 135.00 137.76 1ce8 n PRO 905 Ca 0.10 -1.26 -0.27 0.00 -0.04 0.00 0.00 63.50 62.03 1ce8 n PRO 905 Cb 0.48 -2.27 -0.15 0.00 -0.04 0.00 0.00 33.50 31.53 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 0.07 2.10 0.43 1.53 2.96 -1.26 -4.97 118.68 119.54 1ce8 s LEU 906 Ca 0.46 -0.45 -0.20 0.00 -0.22 0.00 0.00 54.13 53.72 1ce8 s LEU 906 Cb 0.15 -1.06 -0.10 0.00 0.50 0.00 0.00 46.19 45.69 1ce8 s LEU 906 CO -0.02 0.22 0.94 -0.76 -1.32 0.00 0.00 176.35 175.40 1ce8 s LEU 907 N -0.82 3.90 0.00 -0.68 1.43 -1.26 -5.05 118.68 116.20 1ce8 s LEU 907 Ca 0.08 1.64 0.00 0.00 -1.03 0.00 0.00 54.13 54.82 1ce8 s LEU 907 Cb -0.09 -4.50 0.00 0.00 0.03 0.00 0.00 46.19 41.64 1ce8 s LEU 907 CO 0.00 -0.38 0.00 0.61 0.23 0.00 0.00 176.35 176.81 1ce8 n GLY 908 N -0.77 2.15 0.11 -3.19 0.00 -1.26 -4.95 105.19 97.28 1ce8 n GLY 908 Ca 0.07 -0.94 0.11 0.00 0.00 0.00 0.00 46.02 45.26 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 0.17 -3.84 1.61 -0.04 0.53 0.46 135.00 133.90 1ce8 n PRO 909 Ca 0.00 0.39 -0.36 0.00 -0.04 0.00 0.00 63.50 63.50 1ce8 n PRO 909 Cb 0.00 -1.82 -0.08 0.00 -0.04 0.00 0.00 33.50 31.56 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 -3.27 3.88 0.25 0.54 2.12 -1.26 -4.23 118.70 116.73 1ce8 s GLU 910 Ca 0.05 -0.22 -0.30 0.00 0.36 0.00 0.00 54.97 54.87 1ce8 s GLU 910 Cb 0.09 -3.30 -0.09 0.00 0.26 0.00 0.00 34.13 31.10 1ce8 s GLU 910 CO 0.38 0.46 1.05 1.41 -0.54 0.00 0.00 175.26 178.03 1ce8 s MET 911 N -0.13 4.69 0.00 4.30 -2.45 -1.26 -4.70 119.30 119.75 1ce8 s MET 911 Ca 0.10 1.70 0.00 0.00 -1.25 0.00 0.00 55.69 56.23 1ce8 s MET 911 Cb -0.12 -3.23 0.00 0.00 1.25 0.00 0.00 34.83 32.73 1ce8 s MET 911 CO 0.00 0.27 0.01 0.54 1.05 0.00 0.00 175.02 176.90 1ce8 n ARG 912 N 1.51 1.28 -2.12 4.11 3.00 -1.26 -4.93 116.66 118.26 1ce8 n ARG 912 Ca -0.01 -0.01 -0.38 0.00 -0.01 0.00 0.00 57.85 57.45 1ce8 n ARG 912 Cb 0.46 -0.15 0.00 0.00 0.00 0.00 0.00 32.46 32.77 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 -0.19 6.00 -0.13 0.55 1.04 -1.26 -4.42 113.70 115.29 1ce8 s SER 913 Ca 0.00 2.47 0.18 0.00 0.48 0.00 0.00 55.95 59.08 1ce8 s SER 913 Cb 0.00 -2.62 -0.27 0.00 0.10 0.00 0.00 66.02 63.24 1ce8 s SER 913 CO 0.00 -1.05 0.20 0.35 0.98 0.00 0.00 173.24 173.73 1ce8 n THR 914 N -0.48 0.85 -3.69 2.02 -2.24 -0.98 -4.41 114.28 105.36 1ce8 n THR 914 Ca 0.07 -0.69 -0.03 0.00 -2.27 0.00 0.00 64.05 61.13 1ce8 n THR 914 Cb 0.46 -0.31 -0.01 0.00 -2.10 0.00 0.00 70.33 68.38 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 2.98 3.51 3.38 0.00 -1.01 -4.63 105.19 111.07 1ce8 n GLY 915 Ca -0.22 -1.44 -0.10 0.00 0.00 0.00 0.00 46.02 44.26 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 -2.17 1.37 0.10 1.61 -1.05 -1.26 -2.23 118.70 115.06 1ce8 s GLU 916 Ca 0.06 -0.75 0.02 0.00 -0.15 0.00 0.00 54.97 54.15 1ce8 s GLU 916 Cb -0.00 0.55 -0.04 0.00 -0.44 0.00 0.00 34.13 34.19 1ce8 s GLU 916 CO 0.04 -0.59 -0.07 0.14 0.95 0.00 0.00 175.26 175.74 1ce8 s VAL 917 N -3.84 0.72 -0.02 1.83 -7.23 -0.15 -4.20 120.40 107.52 1ce8 s VAL 917 Ca 0.06 -1.94 0.08 0.00 -1.81 0.00 0.00 61.98 58.37 1ce8 s VAL 917 Cb -0.01 -1.70 -0.02 0.00 0.56 0.00 0.00 36.38 35.20 1ce8 s VAL 917 CO -0.06 -0.86 -0.25 -0.32 -0.31 0.00 0.00 175.10 173.31 1ce8 s MET 918 N -3.83 2.12 -0.10 4.82 1.75 -0.21 -1.69 119.30 122.16 1ce8 s MET 918 Ca 0.12 -0.92 0.01 0.00 -1.25 0.00 0.00 55.69 53.66 1ce8 s MET 918 Cb 0.05 -2.07 0.02 0.00 2.84 0.00 0.00 34.83 35.67 1ce8 s MET 918 CO -0.04 0.56 -0.14 0.20 -0.65 0.00 0.00 175.02 174.95 1ce8 s GLY 919 N -0.67 0.97 -0.16 2.11 0.00 0.57 -4.56 107.32 105.58 1ce8 s GLY 919 Ca 0.10 -0.65 -0.04 0.00 0.00 0.00 0.00 44.72 44.13 1ce8 s GLY 919 CO -0.01 0.30 -0.02 0.14 0.00 0.00 0.00 173.10 173.51 1ce8 s VAL 920 N 1.04 4.00 0.13 1.40 1.01 -1.26 0.66 120.40 127.38 1ce8 s VAL 920 Ca -0.06 -0.32 -0.24 0.00 0.00 0.00 0.00 61.98 61.36 1ce8 s VAL 920 Cb -0.15 -2.76 0.07 0.00 0.00 0.00 0.00 36.38 33.54 1ce8 s VAL 920 CO -0.02 0.49 0.60 -0.83 0.00 0.00 0.00 175.10 175.34 1ce8 s GLY 921 N 0.38 -0.59 0.45 4.51 0.00 0.53 -4.33 107.32 108.26 1ce8 s GLY 921 Ca -0.03 0.58 0.30 0.00 0.00 0.00 0.00 44.72 45.57 1ce8 s GLY 921 CO 0.03 0.25 1.90 3.21 0.00 0.00 0.00 173.10 178.49 1ce8 h ARG 922 N 2.17 0.00 -3.92 2.90 3.08 -1.93 0.14 114.38 116.82 1ce8 h ARG 922 Ca -0.33 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.58 1ce8 h ARG 922 Cb 1.28 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 31.14 1ce8 h ARG 922 CO 0.39 0.00 -0.62 0.95 -1.07 0.00 0.00 179.97 179.62 1ce8 s THR 923 N -3.56 0.13 0.35 2.04 -4.23 -1.26 -4.77 115.64 104.34 1ce8 s THR 923 Ca 0.02 -1.10 0.06 0.00 -1.18 0.00 0.00 61.69 59.49 1ce8 s THR 923 Cb 0.09 -0.69 0.30 0.00 1.34 0.00 0.00 72.50 73.54 1ce8 s THR 923 CO 0.48 -0.61 1.92 0.15 -0.54 0.00 0.00 174.62 176.03 1ce8 h PHE 924 N 4.04 0.83 -0.52 3.99 3.57 -1.93 0.47 116.94 127.40 1ce8 h PHE 924 Ca -0.32 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.14 1ce8 h PHE 924 Cb 1.19 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.64 1ce8 h PHE 924 CO 0.59 0.39 0.09 0.00 -2.23 0.00 0.00 178.31 177.16 1ce8 h ALA 925 N 1.59 1.19 0.04 2.41 0.00 -1.95 0.71 119.26 123.24 1ce8 h ALA 925 Ca 0.37 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1ce8 h ALA 925 Cb 0.40 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ce8 h ALA 925 CO -0.14 0.55 -0.02 1.49 0.00 0.00 0.00 179.25 181.12 1ce8 h GLU 926 N 0.77 -0.06 -0.46 0.00 4.81 -0.60 0.05 114.58 119.11 1ce8 h GLU 926 Ca 0.16 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.45 1ce8 h GLU 926 Cb 0.34 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.68 1ce8 h GLU 926 CO 0.00 0.31 0.17 0.00 -0.73 0.00 0.00 179.01 178.77 1ce8 h ALA 927 N 0.50 0.55 -0.00 2.92 0.00 -0.42 0.21 119.26 123.01 1ce8 h ALA 927 Ca -0.01 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1ce8 h ALA 927 Cb 0.39 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1ce8 h ALA 927 CO 0.01 -0.21 -0.01 0.35 0.00 0.00 0.00 179.25 179.39 1ce8 h PHE 928 N 0.35 -0.02 -0.74 0.00 3.04 0.53 0.92 116.94 121.02 1ce8 h PHE 928 Ca 0.21 0.00 0.03 0.00 3.98 0.00 0.00 57.97 62.19 1ce8 h PHE 928 Cb 0.19 0.01 -0.04 0.00 2.56 0.00 0.00 35.95 38.67 1ce8 h PHE 928 CO -0.15 -0.01 0.49 0.00 -2.02 0.00 0.00 178.31 176.62 1ce8 h ALA 929 N 0.99 1.56 -0.12 2.41 0.00 -0.61 0.12 119.26 123.62 1ce8 h ALA 929 Ca 0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1ce8 h ALA 929 Cb 0.02 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 1ce8 h ALA 929 CO -0.01 0.37 -0.10 0.87 0.00 0.00 0.00 179.25 180.38 1ce8 h LYS 930 N 0.91 0.28 -0.46 0.00 1.57 -0.36 -2.17 116.57 116.35 1ce8 h LYS 930 Ca 0.29 -0.14 0.05 0.00 -1.87 0.00 0.00 60.65 58.98 1ce8 h LYS 930 Cb 0.04 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.31 1ce8 h LYS 930 CO -0.08 0.67 0.20 0.00 -0.57 0.00 0.00 179.45 179.67 1ce8 h ALA 931 N 0.60 0.57 -0.85 3.86 0.00 -0.37 -1.42 119.26 121.65 1ce8 h ALA 931 Ca 0.02 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1ce8 h ALA 931 Cb 0.61 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 1ce8 h ALA 931 CO 0.03 -0.16 0.56 0.37 0.00 0.00 0.00 179.25 180.04 1ce8 h GLN 932 N 0.41 1.09 -0.25 0.00 4.15 -0.72 -1.72 115.11 118.06 1ce8 h GLN 932 Ca 0.20 -0.07 -0.16 0.00 0.77 0.00 0.00 58.65 59.40 1ce8 h GLN 932 Cb 0.15 -0.25 -0.01 0.00 0.21 0.00 0.00 27.48 27.59 1ce8 h GLN 932 CO -0.17 0.72 -0.50 1.25 -1.93 0.00 0.00 178.83 178.21 1ce8 h LEU 933 N 1.12 0.75 -1.58 -2.39 5.85 -1.15 -2.28 115.31 115.64 1ce8 h LEU 933 Ca 0.32 -0.38 -0.04 0.00 0.84 0.00 0.00 57.88 58.62 1ce8 h LEU 933 Cb -0.08 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.73 1ce8 h LEU 933 CO -0.09 1.12 -0.15 1.23 -0.34 0.00 0.00 178.44 180.21 1ce8 h GLY 934 N 0.94 0.09 -0.81 3.75 0.00 -0.98 -2.05 103.07 104.00 1ce8 h GLY 934 Ca 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.30 1ce8 h GLY 934 CO 0.10 0.05 0.00 -1.14 0.00 0.00 0.00 176.54 175.55 1ce8 n SER 935 N -4.32 1.08 -1.24 0.19 3.41 -0.67 -4.78 113.62 107.29 1ce8 n SER 935 Ca -0.02 -2.06 -0.12 0.00 -0.26 0.00 0.00 58.87 56.41 1ce8 n SER 935 Cb 0.24 -0.24 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 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 -0.04 -4.12 -4.74 4.04 4.05 -0.77 -4.92 115.26 108.76 1ce8 n ASN 936 Ca 0.04 0.10 -0.34 0.00 0.45 0.00 0.00 54.58 54.84 1ce8 n ASN 936 Cb 0.22 -3.11 0.08 0.00 1.23 0.00 0.00 39.78 38.20 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 -2.60 4.52 -0.00 1.20 0.15 -0.88 -4.91 113.70 111.18 1ce8 s SER 937 Ca 0.00 2.25 0.15 0.00 0.70 0.00 0.00 55.95 59.04 1ce8 s SER 937 Cb 0.00 -2.58 0.42 0.00 -1.71 0.00 0.00 66.02 62.16 1ce8 s SER 937 CO 0.00 -2.04 1.35 0.35 1.20 0.00 0.00 173.24 174.10 1ce8 n THR 938 N -2.58 1.01 -1.60 6.45 -2.24 -1.26 -4.88 114.28 109.18 1ce8 n THR 938 Ca 0.12 -1.00 -0.45 0.00 -2.27 0.00 0.00 64.05 60.45 1ce8 n THR 938 Cb 0.51 0.50 -0.02 0.00 -2.10 0.00 0.00 70.33 69.21 1ce8 n THR 938 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 1ce8 n MET 939 N 0.90 1.38 -4.33 -0.78 0.00 -1.26 -4.53 117.12 108.50 1ce8 n MET 939 Ca 0.16 0.49 -0.25 0.00 -0.00 0.00 0.00 57.70 58.10 1ce8 n MET 939 Cb 0.49 -1.90 -0.09 0.00 0.00 0.00 0.00 33.22 31.73 1ce8 n MET 939 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 1ce8 s LYS 940 N -1.27 2.09 0.00 2.12 -0.14 -1.26 -5.03 119.74 116.25 1ce8 s LYS 940 Ca 0.62 -1.80 0.25 0.00 -1.36 0.00 0.00 55.97 53.68 1ce8 s LYS 940 Cb -0.72 -1.91 0.50 0.00 -1.68 0.00 0.00 37.83 34.02 1ce8 s LYS 940 CO 0.58 0.08 1.41 1.63 -0.76 0.00 0.00 175.35 178.28 1ce8 n LYS 941 N -1.00 0.86 -2.30 1.68 5.02 -1.26 -4.94 118.16 116.22 1ce8 n LYS 941 Ca -0.04 -0.59 -0.04 0.00 -2.02 0.00 0.00 58.31 55.63 1ce8 n LYS 941 Cb 0.63 -1.49 -0.01 0.00 -0.02 0.00 0.00 35.03 34.14 1ce8 n LYS 941 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 1ce8 n HIS 942 N -0.56 -0.36 0.00 2.13 1.44 -1.26 -4.90 115.22 111.71 1ce8 n HIS 942 Ca 0.11 -0.54 0.00 0.00 -2.01 0.00 0.00 57.72 55.28 1ce8 n HIS 942 Cb 0.38 0.08 0.00 0.00 0.12 0.00 0.00 29.99 30.57 1ce8 n HIS 942 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1ce8 n GLY 943 N -0.13 -0.34 3.24 -1.39 0.00 -1.26 -4.74 105.19 100.57 1ce8 n GLY 943 Ca 0.01 -1.94 -0.33 0.00 0.00 0.00 0.00 46.02 43.77 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 3.13 -0.09 1.61 3.52 -1.26 -1.64 118.95 124.22 1ce8 s ARG 944 Ca 0.00 -0.81 -0.07 0.00 -0.13 0.00 0.00 55.73 54.72 1ce8 s ARG 944 Cb 0.00 -2.47 -0.04 0.00 -1.56 0.00 0.00 34.95 30.88 1ce8 s ARG 944 CO 0.00 0.09 0.17 0.00 -0.81 0.00 0.00 175.30 174.75 1ce8 s ALA 945 N 0.60 3.88 -0.16 6.12 0.00 -0.05 -0.97 121.76 131.17 1ce8 s ALA 945 Ca -0.11 -0.62 -0.06 0.00 0.00 0.00 0.00 51.96 51.17 1ce8 s ALA 945 Cb -0.16 -1.99 -0.04 0.00 0.00 0.00 0.00 23.12 20.93 1ce8 s ALA 945 CO 0.03 0.63 0.03 -1.17 0.00 0.00 0.00 175.76 175.28 1ce8 s LEU 946 N -1.18 3.64 -0.16 0.00 2.96 -0.04 -1.54 118.68 122.35 1ce8 s LEU 946 Ca 0.18 0.04 0.02 0.00 -0.22 0.00 0.00 54.13 54.14 1ce8 s LEU 946 Cb -0.12 -1.90 0.02 0.00 0.50 0.00 0.00 46.19 44.69 1ce8 s LEU 946 CO 0.07 0.20 -0.21 -0.76 -1.32 0.00 0.00 176.35 174.34 1ce8 s LEU 947 N 0.18 2.10 -0.34 -0.68 1.02 -0.58 -1.12 118.68 119.26 1ce8 s LEU 947 Ca 0.02 -0.62 0.02 0.00 0.02 0.00 0.00 54.13 53.57 1ce8 s LEU 947 Cb -0.13 -1.45 0.15 0.00 0.02 0.00 0.00 46.19 44.78 1ce8 s LEU 947 CO 0.01 0.03 0.36 -0.55 0.02 0.00 0.00 176.35 176.23 1ce8 s SER 948 N 1.09 1.17 0.26 2.29 0.15 -0.74 -2.69 113.70 115.23 1ce8 s SER 948 Ca -0.00 -1.21 0.11 0.00 0.70 0.00 0.00 55.95 55.55 1ce8 s SER 948 Cb -0.14 0.63 -0.05 0.00 -1.71 0.00 0.00 66.02 64.76 1ce8 s SER 948 CO -0.08 -0.30 -0.14 0.68 1.20 0.00 0.00 173.24 174.59 1ce8 s VAL 949 N 1.82 2.79 0.70 4.45 -7.23 -1.26 -2.14 120.40 119.53 1ce8 s VAL 949 Ca 0.14 -2.20 -0.11 0.00 -1.81 0.00 0.00 61.98 58.00 1ce8 s VAL 949 Cb -0.14 -2.46 0.01 0.00 0.56 0.00 0.00 36.38 34.35 1ce8 s VAL 949 CO -0.15 -0.35 1.08 0.00 -0.31 0.00 0.00 175.10 175.37 1ce8 s ARG 950 N -3.45 2.90 0.09 4.82 1.70 -0.87 -4.80 118.95 119.34 1ce8 s ARG 950 Ca 0.29 0.60 -0.18 0.00 -0.47 0.00 0.00 55.73 55.97 1ce8 s ARG 950 Cb -0.06 -2.01 -0.04 0.00 -0.57 0.00 0.00 34.95 32.27 1ce8 s ARG 950 CO 0.16 -1.04 1.22 -1.91 -1.08 0.00 0.00 175.30 172.65 1ce8 n GLU 951 N -3.03 -0.26 -0.17 3.89 4.07 -1.26 -0.35 120.64 123.52 1ce8 n GLU 951 Ca 0.07 1.20 0.23 0.00 -0.06 0.00 0.00 57.16 58.59 1ce8 n GLU 951 Cb 0.56 -1.77 0.62 0.00 -0.06 0.00 0.00 31.44 30.79 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 0.38 1.74 8.31 0.00 -2.01 0.17 103.07 111.66 1ce8 h GLY 952 Ca 0.09 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1ce8 h GLY 952 CO -0.56 0.00 -0.13 1.22 0.00 0.00 0.00 176.54 177.07 1ce8 n ASP 953 N -4.39 0.13 -0.29 0.19 8.00 0.52 -4.08 116.55 116.63 1ce8 n ASP 953 Ca 0.17 0.30 0.07 0.00 0.71 0.00 0.00 54.79 56.05 1ce8 n ASP 953 Cb 0.77 -0.30 0.22 0.00 -0.02 0.00 0.00 41.12 41.79 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 0.60 0.22 -1.24 1.57 -0.07 0.43 116.57 118.07 1ce8 h LYS 954 Ca 0.00 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1ce8 h LYS 954 Cb 0.50 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1ce8 h LYS 954 CO 0.00 0.39 -0.10 1.49 -0.57 0.00 0.00 179.45 180.66 1ce8 h GLU 955 N 0.61 -0.28 -0.74 3.15 4.81 -1.74 -3.29 114.58 117.11 1ce8 h GLU 955 Ca 0.46 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.67 1ce8 h GLU 955 Cb 0.66 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.07 1ce8 h GLU 955 CO -0.37 0.06 0.30 0.00 -0.73 0.00 0.00 179.01 178.27 1ce8 h ARG 956 N -0.65 1.09 0.00 1.92 3.08 -1.74 -3.15 114.38 114.92 1ce8 h ARG 956 Ca -0.03 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 59.83 1ce8 h ARG 956 Cb 0.46 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1ce8 h ARG 956 CO 0.05 0.88 0.45 -0.24 -1.07 0.00 0.00 179.97 180.04 1ce8 h VAL 957 N 1.07 0.00 -0.30 2.04 3.04 -0.98 -1.98 116.25 119.13 1ce8 h VAL 957 Ca 0.25 0.00 -0.03 0.00 -1.01 0.00 0.00 66.70 65.91 1ce8 h VAL 957 Cb 0.20 0.51 -0.01 0.00 -2.01 0.00 0.00 31.29 29.97 1ce8 h VAL 957 CO -0.02 0.00 0.09 0.58 -1.01 0.00 0.00 177.57 177.21 1ce8 h VAL 958 N 0.00 1.21 -0.73 1.51 2.07 -1.71 0.11 116.25 118.70 1ce8 h VAL 958 Ca 0.00 -0.67 -0.00 0.00 0.82 0.00 0.00 66.70 66.85 1ce8 h VAL 958 Cb 0.91 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.71 1ce8 h VAL 958 CO 0.00 0.22 0.45 -0.78 0.02 0.00 0.00 177.57 177.48 1ce8 h ASP 959 N 0.33 0.88 -0.33 0.57 3.58 -1.60 0.32 116.42 120.17 1ce8 h ASP 959 Ca 0.10 -0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.47 1ce8 h ASP 959 Cb 0.25 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 41.07 1ce8 h ASP 959 CO -0.00 0.68 0.15 0.25 -2.88 0.00 0.00 179.24 177.43 1ce8 h LEU 960 N 1.00 0.45 -1.17 2.28 5.85 -1.50 0.39 115.31 122.61 1ce8 h LEU 960 Ca 0.26 -0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.87 1ce8 h LEU 960 Cb -0.04 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 40.82 1ce8 h LEU 960 CO -0.05 0.47 0.57 0.00 -0.34 0.00 0.00 178.44 179.09 1ce8 h ALA 961 N 1.00 1.45 -0.14 1.25 0.00 -0.08 -0.84 119.26 121.90 1ce8 h ALA 961 Ca 0.11 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1ce8 h ALA 961 Cb 0.15 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1ce8 h ALA 961 CO -0.01 0.47 0.06 0.00 0.00 0.00 0.00 179.25 179.77 1ce8 h ALA 962 N 1.49 0.18 -0.75 0.00 0.00 0.55 -2.38 119.26 118.35 1ce8 h ALA 962 Ca 0.34 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 55.25 1ce8 h ALA 962 Cb 0.00 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 17.67 1ce8 h ALA 962 CO -0.10 -0.24 0.40 0.87 0.00 0.00 0.00 179.25 180.18 1ce8 h LYS 963 N 0.08 0.65 -0.66 0.00 1.57 0.80 0.26 116.57 119.27 1ce8 h LYS 963 Ca 0.05 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.72 1ce8 h LYS 963 Cb 0.16 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.29 1ce8 h LYS 963 CO -0.00 0.43 0.15 -0.07 -0.57 0.00 0.00 179.45 179.38 1ce8 h LEU 964 N 0.67 0.99 -0.32 2.94 3.38 -1.10 0.49 115.31 122.36 1ce8 h LEU 964 Ca 0.37 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1ce8 h LEU 964 Cb 0.37 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1ce8 h LEU 964 CO -0.26 0.96 0.18 -0.07 0.09 0.00 0.00 178.44 179.34 1ce8 h LEU 965 N 0.99 0.40 -0.71 1.67 3.38 -0.82 0.81 115.31 121.04 1ce8 h LEU 965 Ca 0.21 -0.09 0.12 0.00 0.09 0.00 0.00 57.88 58.21 1ce8 h LEU 965 Cb 0.37 -0.10 -0.08 0.00 0.09 0.00 0.00 40.66 40.94 1ce8 h LEU 965 CO 0.00 0.37 0.30 0.11 0.09 0.00 0.00 178.44 179.32 1ce8 h LYS 966 N 0.40 0.46 0.00 1.13 1.57 -0.47 1.11 116.57 120.77 1ce8 h LYS 966 Ca 0.11 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1ce8 h LYS 966 Cb 0.06 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.27 1ce8 h LYS 966 CO -0.02 0.31 0.00 1.04 -0.57 0.00 0.00 179.45 180.21 1ce8 n GLN 967 N -4.96 0.28 -0.57 3.15 1.13 0.12 -4.83 117.38 111.70 1ce8 n GLN 967 Ca 0.12 0.11 0.00 0.00 -1.94 0.00 0.00 57.00 55.29 1ce8 n GLN 967 Cb 0.34 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.19 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 -0.04 0.70 3.87 1.08 0.00 0.38 -4.88 105.19 106.30 1ce8 n GLY 968 Ca 0.08 -0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.66 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 3.47 0.01 1.61 0.40 0.26 -4.69 117.98 117.04 1ce8 s PHE 969 Ca 0.00 1.06 -0.07 0.00 -0.60 0.00 0.00 56.93 57.33 1ce8 s PHE 969 Cb 0.00 -2.46 -0.05 0.00 0.51 0.00 0.00 43.02 41.02 1ce8 s PHE 969 CO 0.00 -0.12 0.27 -1.21 0.70 0.00 0.00 175.22 174.86 1ce8 s GLU 970 N -3.85 3.58 0.15 0.44 2.02 -0.65 -4.15 118.70 116.24 1ce8 s GLU 970 Ca 0.52 -0.07 0.09 0.00 0.02 0.00 0.00 54.97 55.53 1ce8 s GLU 970 Cb -0.10 -3.08 -0.04 0.00 0.10 0.00 0.00 34.13 31.01 1ce8 s GLU 970 CO 0.31 0.65 -0.17 -0.51 0.02 0.00 0.00 175.26 175.56 1ce8 s LEU 971 N -1.77 2.71 0.17 1.80 1.43 -1.26 -0.87 118.68 120.89 1ce8 s LEU 971 Ca 0.28 -0.63 0.08 0.00 -1.03 0.00 0.00 54.13 52.82 1ce8 s LEU 971 Cb -0.13 -1.49 -0.04 0.00 0.03 0.00 0.00 46.19 44.55 1ce8 s LEU 971 CO 0.16 0.15 -0.17 -1.81 0.23 0.00 0.00 176.35 174.91 1ce8 s ASP 972 N -2.44 2.53 -0.12 2.29 1.11 -0.59 -0.22 116.67 119.24 1ce8 s ASP 972 Ca 0.20 -0.89 -0.30 0.00 0.18 0.00 0.00 52.55 51.75 1ce8 s ASP 972 Cb -0.10 -0.14 0.09 0.00 1.07 0.00 0.00 42.92 43.85 1ce8 s ASP 972 CO 0.11 -0.09 0.79 0.00 1.18 0.00 0.00 175.17 177.17 1ce8 s ALA 973 N -2.27 -1.83 0.59 5.23 0.00 0.40 -1.53 121.76 122.35 1ce8 s ALA 973 Ca 0.16 1.52 -0.15 0.00 0.00 0.00 0.00 51.96 53.49 1ce8 s ALA 973 Cb -0.04 -0.43 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 1ce8 s ALA 973 CO 0.06 -0.34 1.03 0.95 0.00 0.00 0.00 175.76 177.46 1ce8 s THR 974 N -0.87 4.20 0.02 0.00 -4.23 -1.10 -2.44 115.64 111.23 1ce8 s THR 974 Ca -0.06 0.95 -0.04 0.00 -1.18 0.00 0.00 61.69 61.36 1ce8 s THR 974 Cb -0.01 -3.56 -0.01 0.00 1.34 0.00 0.00 72.50 70.26 1ce8 s THR 974 CO 0.06 -0.70 0.55 1.57 -0.54 0.00 0.00 174.62 175.55 1ce8 n HIS 975 N -2.13 -0.06 -0.32 3.99 -0.00 -1.26 -0.38 115.22 115.06 1ce8 n HIS 975 Ca 0.07 0.16 -0.04 0.00 0.46 0.00 0.00 57.72 58.38 1ce8 n HIS 975 Cb 0.53 -0.32 0.08 0.00 -0.12 0.00 0.00 29.99 30.17 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 1.31 0.92 1.57 0.00 -1.97 -0.91 103.07 103.99 1ce8 h GLY 976 Ca 0.02 -0.59 -0.03 0.00 0.00 0.00 0.00 47.33 46.73 1ce8 h GLY 976 CO -0.12 0.57 0.10 -0.84 0.00 0.00 0.00 176.54 176.25 1ce8 h THR 977 N 1.22 1.22 -0.16 4.70 2.02 -1.63 -2.30 112.91 117.98 1ce8 h THR 977 Ca 0.31 -0.73 -0.02 0.00 0.77 0.00 0.00 66.41 66.74 1ce8 h THR 977 Cb 0.03 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.43 1ce8 h THR 977 CO -0.05 0.25 0.00 0.00 0.37 0.00 0.00 175.52 176.09 1ce8 h ALA 978 N 0.94 1.71 0.57 6.16 0.00 -0.24 -1.61 119.26 126.79 1ce8 h ALA 978 Ca 0.12 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1ce8 h ALA 978 Cb 0.28 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1ce8 h ALA 978 CO -0.00 0.23 -0.41 0.82 0.00 0.00 0.00 179.25 179.88 1ce8 h ILE 979 N 0.23 0.00 -0.87 0.00 1.08 -0.61 0.49 117.51 117.83 1ce8 h ILE 979 Ca 0.06 0.00 0.10 0.00 -0.39 0.00 0.00 64.86 64.62 1ce8 h ILE 979 Cb 0.16 0.00 -0.06 0.00 -3.07 0.00 0.00 36.82 33.84 1ce8 h ILE 979 CO 0.00 0.00 0.56 0.58 -0.69 0.00 0.00 178.15 178.60 1ce8 h VAL 980 N -0.94 0.96 -0.15 1.67 2.07 -1.30 -0.65 116.25 117.91 1ce8 h VAL 980 Ca -0.08 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 1ce8 h VAL 980 Cb 0.78 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 1ce8 h VAL 980 CO 0.03 0.15 0.01 -0.07 0.02 0.00 0.00 177.57 177.72 1ce8 h LEU 981 N 0.84 0.26 -1.00 2.57 3.38 -0.99 -2.84 115.31 117.53 1ce8 h LEU 981 Ca 0.40 -0.29 0.04 0.00 0.09 0.00 0.00 57.88 58.12 1ce8 h LEU 981 Cb 0.43 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.05 1ce8 h LEU 981 CO -0.17 0.49 0.66 1.23 0.09 0.00 0.00 178.44 180.73 1ce8 h GLY 982 N 0.02 1.47 2.00 0.83 0.00 0.11 0.23 103.07 107.74 1ce8 h GLY 982 Ca 0.05 -0.50 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1ce8 h GLY 982 CO 0.01 0.42 0.00 1.18 0.00 0.00 0.00 176.54 178.15 1ce8 n GLU 983 N -4.45 0.02 0.00 4.80 -0.58 -0.32 -0.99 120.64 119.12 1ce8 n GLU 983 Ca 0.14 0.40 0.06 0.00 -0.42 0.00 0.00 57.16 57.34 1ce8 n GLU 983 Cb 0.10 -1.55 0.00 0.00 -0.57 0.00 0.00 31.44 29.42 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 -1.53 2.91 -0.20 0.62 0.00 0.64 -4.98 120.51 117.97 1ce8 n ALA 984 Ca 0.01 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.97 1ce8 n ALA 984 Cb 0.09 -0.43 0.00 0.00 0.00 0.00 0.00 19.45 19.11 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 0.96 0.68 3.40 0.00 0.00 -0.16 -5.05 105.19 105.02 1ce8 n GLY 985 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.29 4.46 -0.74 -0.61 1.01 -0.24 -4.96 121.20 117.82 1ce8 s ILE 986 Ca 0.00 -0.61 -0.08 0.00 0.00 0.00 0.00 60.65 59.96 1ce8 s ILE 986 Cb 0.00 -3.34 0.19 0.00 0.01 0.00 0.00 42.46 39.32 1ce8 s ILE 986 CO 0.00 -0.02 0.62 0.20 0.00 0.00 0.00 174.94 175.74 1ce8 s ASN 987 N 1.57 5.96 0.93 3.58 0.02 -1.26 -0.83 114.94 124.91 1ce8 s ASN 987 Ca 0.03 -2.88 -0.12 0.00 -1.02 0.00 0.00 52.86 48.87 1ce8 s ASN 987 Cb -0.18 -2.01 0.15 0.00 0.02 0.00 0.00 41.25 39.23 1ce8 s ASN 987 CO 0.06 -0.43 1.11 -2.16 0.02 0.00 0.00 177.10 175.69 1ce8 s PRO 988 N -0.11 0.99 0.17 -0.60 0.04 -1.26 -4.99 135.00 129.25 1ce8 s PRO 988 Ca 0.18 0.44 -0.27 0.00 0.04 0.00 0.00 61.00 61.40 1ce8 s PRO 988 Cb -0.15 -1.81 -0.08 0.00 0.04 0.00 0.00 34.50 32.50 1ce8 s PRO 988 CO -0.06 -2.33 0.82 0.50 0.04 0.00 0.00 177.00 175.97 1ce8 s ARG 989 N -5.13 4.64 0.09 4.56 3.52 0.70 -4.85 118.95 122.47 1ce8 s ARG 989 Ca 0.64 1.25 -0.19 0.00 -0.13 0.00 0.00 55.73 57.29 1ce8 s ARG 989 Cb -0.16 -3.28 -0.07 0.00 -1.56 0.00 0.00 34.95 29.88 1ce8 s ARG 989 CO 0.55 0.52 0.58 -1.17 -0.81 0.00 0.00 175.30 174.98 1ce8 s LEU 990 N -1.02 4.52 0.06 -0.88 2.96 -1.26 -0.45 118.68 122.61 1ce8 s LEU 990 Ca 0.38 1.28 0.05 0.00 -0.22 0.00 0.00 54.13 55.61 1ce8 s LEU 990 Cb -0.24 -2.96 -0.03 0.00 0.50 0.00 0.00 46.19 43.47 1ce8 s LEU 990 CO 0.28 0.26 -0.13 0.54 -1.32 0.00 0.00 176.35 175.97 1ce8 s VAL 991 N -1.14 1.04 0.09 1.68 0.11 -1.02 -4.87 120.40 116.28 1ce8 s VAL 991 Ca 0.30 -1.22 -0.04 0.00 -2.93 0.00 0.00 61.98 58.09 1ce8 s VAL 991 Cb -0.19 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.60 1ce8 s VAL 991 CO 0.20 -0.21 0.30 0.20 -3.33 0.00 0.00 175.10 172.26 1ce8 s ASN 992 N -1.62 6.45 0.70 3.54 0.02 -0.55 -4.31 114.94 119.18 1ce8 s ASN 992 Ca -0.02 0.49 -0.12 0.00 -1.02 0.00 0.00 52.86 52.18 1ce8 s ASN 992 Cb -0.10 -2.05 0.02 0.00 0.02 0.00 0.00 41.25 39.14 1ce8 s ASN 992 CO 0.02 0.13 1.08 -0.54 0.02 0.00 0.00 177.10 177.81 1ce8 s LYS 993 N -2.42 2.70 0.21 -0.60 1.02 -1.26 -0.55 119.74 118.84 1ce8 s LYS 993 Ca 0.36 1.17 -0.12 0.00 0.02 0.00 0.00 55.97 57.41 1ce8 s LYS 993 Cb -0.13 -1.95 0.26 0.00 -0.52 0.00 0.00 37.83 35.49 1ce8 s LYS 993 CO 0.24 -1.30 1.66 0.28 -0.92 0.00 0.00 175.35 175.31 1ce8 h VAL 994 N -0.53 0.51 0.00 3.17 2.07 -1.93 0.80 116.25 120.34 1ce8 h VAL 994 Ca -0.45 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.04 1ce8 h VAL 994 Cb 1.23 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.40 1ce8 h VAL 994 CO 0.54 0.02 0.00 0.00 0.02 0.00 0.00 177.57 178.15 1ce8 n HIS 995 N -5.28 0.00 0.64 1.57 1.44 -1.26 -2.15 115.22 110.18 1ce8 n HIS 995 Ca 0.08 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.91 1ce8 n HIS 995 Cb 0.33 -0.43 0.17 0.00 0.12 0.00 0.00 29.99 30.18 1ce8 n HIS 995 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1ce8 n GLU 996 N -1.43 0.24 0.00 -1.40 1.02 0.27 -5.07 120.64 114.27 1ce8 n GLU 996 Ca 0.05 0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 1ce8 n GLU 996 Cb 0.16 -1.64 0.00 0.00 -0.02 0.00 0.00 31.44 29.94 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 1.37 0.51 3.77 0.62 0.00 -0.91 -4.91 105.19 105.64 1ce8 n GLY 997 Ca 0.03 -2.07 -0.35 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 -1.20 3.30 0.03 1.61 0.52 -1.26 -3.31 118.95 118.64 1ce8 s ARG 998 Ca 0.00 1.67 -0.26 0.00 -0.52 0.00 0.00 55.73 56.62 1ce8 s ARG 998 Cb 0.00 -2.02 -0.05 0.00 0.52 0.00 0.00 34.95 33.40 1ce8 s ARG 998 CO 0.00 -0.90 0.80 -1.25 0.02 0.00 0.00 175.30 173.97 1ce8 s PRO 999 N -3.25 4.51 0.31 3.54 0.04 -1.26 -4.96 135.00 133.94 1ce8 s PRO 999 Ca 0.73 1.11 0.10 0.00 0.04 0.00 0.00 61.00 62.98 1ce8 s PRO 999 Cb -0.26 -3.39 -0.05 0.00 0.04 0.00 0.00 34.50 30.84 1ce8 s PRO 999 CO 0.29 0.20 -0.06 -3.38 0.04 0.00 0.00 177.00 174.09 1ce8 s HIS 1000N 0.20 2.49 0.27 0.56 -3.43 -1.21 -1.49 115.29 112.68 1ce8 s HIS 1000Ca 0.41 -0.38 -0.04 0.00 -0.80 0.00 0.00 55.06 54.25 1ce8 s HIS 1000Cb -0.20 -1.30 0.54 0.00 -1.43 0.00 0.00 32.58 30.20 1ce8 s HIS 1000CO 0.23 0.58 1.62 -0.84 -2.00 0.00 0.00 174.74 174.34 1ce8 h ILE 1001N 1.97 0.26 -0.30 -5.38 -0.00 -1.11 -1.13 117.51 111.81 1ce8 h ILE 1001Ca -0.42 -0.03 0.07 0.00 -0.00 0.00 0.00 64.86 64.47 1ce8 h ILE 1001Cb 1.25 0.15 -0.06 0.00 -0.00 0.00 0.00 36.82 38.16 1ce8 h ILE 1001CO 0.64 0.02 -0.12 -0.61 -0.00 0.00 0.00 178.15 178.08 1ce8 h GLN 1002N 0.10 -0.06 -0.13 0.16 4.15 -1.93 0.41 115.11 117.81 1ce8 h GLN 1002Ca 0.48 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.90 1ce8 h GLN 1002Cb 0.89 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.59 1ce8 h GLN 1002CO -0.73 -0.04 0.08 -0.44 -1.93 0.00 0.00 178.83 175.76 1ce8 h ASP 1003N -0.07 0.15 -0.78 -0.69 3.32 -1.64 -0.48 116.42 116.23 1ce8 h ASP 1003Ca 0.15 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.14 1ce8 h ASP 1003Cb 0.30 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.78 1ce8 h ASP 1003CO -0.35 0.15 0.43 0.03 -1.72 0.00 0.00 179.24 177.78 1ce8 h ARG 1004N 0.14 1.09 0.48 3.56 3.08 -0.81 0.20 114.38 122.12 1ce8 h ARG 1004Ca 0.05 -0.13 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 1ce8 h ARG 1004Cb 0.03 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 29.87 1ce8 h ARG 1004CO -0.01 0.81 -0.23 0.82 -1.07 0.00 0.00 179.97 180.29 1ce8 h ILE 1005N 1.08 0.52 -0.75 2.04 2.04 -0.02 -0.24 117.51 122.18 1ce8 h ILE 1005Ca 0.27 -0.13 0.13 0.00 1.00 0.00 0.00 64.86 66.13 1ce8 h ILE 1005Cb 0.03 0.59 -0.05 0.00 -0.74 0.00 0.00 36.82 36.65 1ce8 h ILE 1005CO -0.04 0.02 0.50 0.50 0.00 0.00 0.00 178.15 179.13 1ce8 h LYS 1006N -0.72 0.51 -0.11 2.37 3.64 -0.86 0.90 116.57 122.29 1ce8 h LYS 1006Ca -0.07 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1ce8 h LYS 1006Cb 0.53 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1ce8 h LYS 1006CO 0.11 0.34 0.00 0.09 -2.27 0.00 0.00 179.45 177.72 1ce8 n ASN 1007N -4.49 0.85 -3.34 4.20 3.02 0.69 -4.91 115.26 111.27 1ce8 n ASN 1007Ca 0.14 -1.73 -0.16 0.00 -0.03 0.00 0.00 54.58 52.80 1ce8 n ASN 1007Cb 0.44 -0.07 0.08 0.00 -0.61 0.00 0.00 39.78 39.62 1ce8 n ASN 1007CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ce8 n GLY 1008N 0.89 -0.67 0.04 7.41 0.00 0.31 -4.93 105.19 108.24 1ce8 n GLY 1008Ca 0.12 0.29 0.11 0.00 0.00 0.00 0.00 46.02 46.54 1ce8 n GLY 1008CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ce8 n GLU 1009N -3.75 0.33 -4.39 1.61 1.02 -0.18 -4.92 120.64 110.36 1ce8 n GLU 1009Ca -0.20 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.66 1ce8 n GLU 1009Cb 0.65 -1.61 -0.12 0.00 -0.02 0.00 0.00 31.44 30.33 1ce8 n GLU 1009CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1ce8 s TYR 1010N -3.22 2.33 -0.24 -0.32 2.02 -1.26 -4.10 117.35 112.55 1ce8 s TYR 1010Ca 0.03 -0.36 0.05 0.00 -0.37 0.00 0.00 57.07 56.42 1ce8 s TYR 1010Cb 0.14 -1.21 -0.06 0.00 -0.40 0.00 0.00 41.96 40.42 1ce8 s TYR 1010CO 0.80 0.41 0.23 0.25 -1.57 0.00 0.00 175.55 175.67 1ce8 n THR 1011N 0.63 0.00 -3.74 -0.71 -2.24 -0.15 -4.90 114.28 103.17 1ce8 n THR 1011Ca -0.16 -0.35 -0.13 0.00 -2.27 0.00 0.00 64.05 61.14 1ce8 n THR 1011Cb 0.54 0.95 -0.09 0.00 -2.10 0.00 0.00 70.33 69.63 1ce8 n THR 1011CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1ce8 s TYR 1012N -1.58 -0.36 -0.02 4.78 5.04 -1.23 -3.91 117.35 120.06 1ce8 s TYR 1012Ca 0.02 0.80 0.00 0.00 -2.44 0.00 0.00 57.07 55.45 1ce8 s TYR 1012Cb 0.04 0.14 0.03 0.00 0.35 0.00 0.00 41.96 42.52 1ce8 s TYR 1012CO 0.23 -0.28 0.01 0.42 -1.34 0.00 0.00 175.55 174.59 1ce8 s ILE 1013N -0.35 0.05 -0.28 3.14 1.01 -0.46 -0.87 121.20 123.45 1ce8 s ILE 1013Ca -0.05 0.15 0.02 0.00 0.00 0.00 0.00 60.65 60.76 1ce8 s ILE 1013Cb -0.03 -0.16 0.06 0.00 0.01 0.00 0.00 42.46 42.34 1ce8 s ILE 1013CO 0.02 0.11 -0.07 -0.51 0.00 0.00 0.00 174.94 174.49 1ce8 s ILE 1014N 0.98 2.44 -0.21 2.92 1.10 -0.27 -0.19 121.20 127.97 1ce8 s ILE 1014Ca -0.09 -1.59 -0.01 0.00 -0.51 0.00 0.00 60.65 58.45 1ce8 s ILE 1014Cb -0.12 -2.44 0.06 0.00 0.15 0.00 0.00 42.46 40.10 1ce8 s ILE 1014CO -0.02 -0.08 -0.01 0.21 -2.11 0.00 0.00 174.94 172.93 1ce8 s ASN 1015N 1.15 3.26 0.03 4.50 3.84 -0.78 -1.79 114.94 125.15 1ce8 s ASN 1015Ca -0.07 -0.94 0.07 0.00 0.21 0.00 0.00 52.86 52.14 1ce8 s ASN 1015Cb -0.20 -0.86 -0.03 0.00 -0.55 0.00 0.00 41.25 39.61 1ce8 s ASN 1015CO -0.04 -0.26 -0.20 0.42 -2.79 0.00 0.00 177.10 174.23 1ce8 s THR 1016N 1.65 2.64 -0.02 -5.21 -4.23 -0.91 -4.17 115.64 105.39 1ce8 s THR 1016Ca -0.03 -1.19 -0.17 0.00 -1.18 0.00 0.00 61.69 59.12 1ce8 s THR 1016Cb -0.18 -2.08 0.03 0.00 1.34 0.00 0.00 72.50 71.61 1ce8 s THR 1016CO -0.07 0.37 0.37 -0.89 -0.54 0.00 0.00 174.62 173.86 1ce8 s THR 1017N -0.87 0.05 -0.04 3.99 2.01 -1.26 -2.05 115.64 117.46 1ce8 s THR 1017Ca 0.14 -0.39 -0.02 0.00 0.31 0.00 0.00 61.69 61.73 1ce8 s THR 1017Cb -0.10 -0.67 0.02 0.00 0.01 0.00 0.00 72.50 71.76 1ce8 s THR 1017CO 0.04 -0.21 0.09 -0.44 -0.69 0.00 0.00 174.62 173.41 1ce8 s SER 1018N -1.25 -0.07 0.00 3.53 0.01 -1.26 -4.99 113.70 109.68 1ce8 s SER 1018Ca -0.13 0.19 0.00 0.00 1.31 0.00 0.00 55.95 57.32 1ce8 s SER 1018Cb -0.04 0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.32 1ce8 s SER 1018CO 0.05 -0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.23 1ce8 n GLY 1019N 3.60 2.80 0.26 3.44 0.00 -1.26 -4.69 105.19 109.33 1ce8 n GLY 1019Ca -0.19 -1.54 -0.13 0.00 0.00 0.00 0.00 46.02 44.16 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 0.00 -0.43 -0.27 1.61 9.65 -2.00 -1.31 114.38 121.63 1ce8 h ARG 1020Ca 0.00 0.03 -0.19 0.00 -1.10 0.00 0.00 59.98 58.72 1ce8 h ARG 1020Cb 0.00 0.10 0.00 0.00 -1.39 0.00 0.00 29.97 28.68 1ce8 h ARG 1020CO 0.00 -0.29 -0.56 -0.09 2.80 0.00 0.00 179.97 181.83 1ce8 h ARG 1021N -0.45 0.85 -0.94 0.20 2.43 -1.98 -2.10 114.38 112.39 1ce8 h ARG 1021Ca 0.01 -0.55 0.13 0.00 -0.81 0.00 0.00 59.98 58.77 1ce8 h ARG 1021Cb 0.44 0.07 -0.09 0.00 -0.42 0.00 0.00 29.97 29.97 1ce8 h ARG 1021CO -0.08 1.18 0.55 0.00 -1.51 0.00 0.00 179.97 180.11 1ce8 h ALA 1022N 0.71 1.43 0.10 2.80 0.00 -1.83 0.72 119.26 123.19 1ce8 h ALA 1022Ca 0.01 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ce8 h ALA 1022Cb 1.17 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1ce8 h ALA 1022CO 0.12 0.08 -0.05 0.82 0.00 0.00 0.00 179.25 180.23 1ce8 h ILE 1023N 0.83 1.10 -0.94 0.00 2.04 -1.15 -2.49 117.51 116.91 1ce8 h ILE 1023Ca 0.49 -0.86 0.19 0.00 1.00 0.00 0.00 64.86 65.68 1ce8 h ILE 1023Cb 0.58 1.64 -0.08 0.00 -0.74 0.00 0.00 36.82 38.21 1ce8 h ILE 1023CO -0.31 0.21 0.60 -0.33 0.00 0.00 0.00 178.15 178.32 1ce8 h GLU 1024N -0.55 0.53 0.00 2.37 5.08 -0.49 -0.40 114.58 121.13 1ce8 h GLU 1024Ca -0.01 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 58.14 1ce8 h GLU 1024Cb 0.44 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1ce8 h GLU 1024CO 0.02 0.35 -0.82 -0.44 -1.00 0.00 0.00 179.01 177.13 1ce8 h ASP 1025N 0.55 0.00 -0.44 1.42 3.32 0.45 -3.25 116.42 118.47 1ce8 h ASP 1025Ca 0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.55 1ce8 h ASP 1025Cb 1.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.59 1ce8 h ASP 1025CO -0.24 0.82 0.00 -1.54 -1.72 0.00 0.00 179.24 176.56 1ce8 n SER 1026N -3.39 3.16 -0.34 6.45 3.41 -0.31 -4.54 113.62 118.07 1ce8 n SER 1026Ca 0.00 -1.95 0.21 0.00 -0.26 0.00 0.00 58.87 56.86 1ce8 n SER 1026Cb 0.83 -0.29 0.43 0.00 -0.26 0.00 0.00 64.21 64.92 1ce8 n SER 1026CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1ce8 h ARG 1027N 3.86 0.43 -0.98 4.33 2.43 -1.19 -2.09 114.38 121.16 1ce8 h ARG 1027Ca 0.00 -0.03 0.16 0.00 -0.81 0.00 0.00 59.98 59.30 1ce8 h ARG 1027Cb 0.86 -0.10 -0.09 0.00 -0.42 0.00 0.00 29.97 30.22 1ce8 h ARG 1027CO 0.00 0.28 0.62 -0.24 -1.51 0.00 0.00 179.97 179.12 1ce8 h VAL 1028N 0.44 0.81 -0.23 0.20 3.04 -1.86 -1.71 116.25 116.94 1ce8 h VAL 1028Ca 0.69 -0.28 -0.14 0.00 -1.01 0.00 0.00 66.70 65.96 1ce8 h VAL 1028Cb 1.45 -0.09 -0.00 0.00 -2.01 0.00 0.00 31.29 30.64 1ce8 h VAL 1028CO -0.55 0.15 -0.39 -0.29 -1.01 0.00 0.00 177.57 175.49 1ce8 h ILE 1029N 0.83 1.31 -0.36 3.17 2.10 -1.74 -0.81 117.51 122.01 1ce8 h ILE 1029Ca 0.52 -1.60 -0.09 0.00 1.08 0.00 0.00 64.86 64.77 1ce8 h ILE 1029Cb 0.73 1.77 -0.01 0.00 -1.09 0.00 0.00 36.82 38.22 1ce8 h ILE 1029CO -0.30 0.50 -0.14 0.03 -1.08 0.00 0.00 178.15 177.16 1ce8 h ARG 1030N 0.38 0.73 -0.56 2.19 3.08 -1.61 0.22 114.38 118.82 1ce8 h ARG 1030Ca 0.02 -0.31 -0.06 0.00 0.07 0.00 0.00 59.98 59.70 1ce8 h ARG 1030Cb 0.98 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.98 1ce8 h ARG 1030CO 0.09 0.91 0.10 0.00 -1.07 0.00 0.00 179.97 180.00 1ce8 h ARG 1031N 0.52 0.92 -0.64 0.04 3.08 -1.34 -0.78 114.38 116.18 1ce8 h ARG 1031Ca 0.09 -0.24 -0.05 0.00 0.07 0.00 0.00 59.98 59.84 1ce8 h ARG 1031Cb 0.67 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.58 1ce8 h ARG 1031CO 0.05 0.88 0.19 0.77 -1.07 0.00 0.00 179.97 180.78 1ce8 h SER 1032N 0.81 0.95 -0.15 7.04 0.02 -1.03 -0.21 113.55 120.97 1ce8 h SER 1032Ca 0.17 -0.21 0.04 0.00 -0.84 0.00 0.00 61.79 60.94 1ce8 h SER 1032Cb 0.40 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 62.65 1ce8 h SER 1032CO 0.01 0.91 -0.07 0.00 -1.14 0.00 0.00 176.83 176.54 1ce8 h ALA 1033N 1.07 0.06 -0.16 3.77 0.00 -0.04 -1.14 119.26 122.82 1ce8 h ALA 1033Ca 0.21 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1ce8 h ALA 1033Cb 0.31 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1ce8 h ALA 1033CO -0.00 -0.51 0.10 1.25 0.00 0.00 0.00 179.25 180.08 1ce8 h LEU 1034N -0.05 0.19 -1.51 0.00 5.85 -0.93 -1.69 115.31 117.18 1ce8 h LEU 1034Ca 0.08 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 1ce8 h LEU 1034Cb 0.18 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 1ce8 h LEU 1034CO -0.19 0.19 0.14 -0.61 -0.34 0.00 0.00 178.44 177.63 1ce8 h GLN 1035N 0.18 0.46 -0.00 1.25 4.15 -0.78 -2.85 115.11 117.51 1ce8 h GLN 1035Ca 0.06 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1ce8 h GLN 1035Cb 0.03 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.63 1ce8 h GLN 1035CO -0.01 0.38 -0.32 0.66 -1.93 0.00 0.00 178.83 177.61 1ce8 n TYR 1036N -4.41 0.00 -1.02 3.99 4.01 -0.45 -4.97 117.16 114.32 1ce8 n TYR 1036Ca 0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.76 1ce8 n TYR 1036Cb 0.13 -0.21 0.00 0.00 -0.31 0.00 0.00 39.34 38.95 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 -1.10 0.00 -3.08 -0.72 4.76 -0.71 -5.02 118.16 112.29 1ce8 n LYS 1037Ca 0.09 0.49 -0.40 0.00 -2.87 0.00 0.00 58.31 55.62 1ce8 n LYS 1037Cb 0.33 -3.97 -0.06 0.00 -1.84 0.00 0.00 35.03 29.50 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 -2.00 5.00 0.22 -0.18 1.01 -0.76 -4.72 120.40 118.97 1ce8 s VAL 1038Ca 0.00 1.25 -0.32 0.00 0.00 0.00 0.00 61.98 62.91 1ce8 s VAL 1038Cb 0.00 -3.97 -0.12 0.00 0.00 0.00 0.00 36.38 32.29 1ce8 s VAL 1038CO 0.00 0.10 1.69 1.57 0.00 0.00 0.00 175.10 178.46 1ce8 n HIS 1039N 5.06 2.73 -3.93 5.22 -0.00 -1.25 -4.58 115.22 118.46 1ce8 n HIS 1039Ca -0.01 0.09 -0.10 0.00 0.46 0.00 0.00 57.72 58.16 1ce8 n HIS 1039Cb 0.50 -2.65 -0.12 0.00 -0.12 0.00 0.00 29.99 27.60 1ce8 n HIS 1039CO 0.00 0.00 0.00 1.52 0.46 0.00 0.00 176.34 178.32 1ce8 s TYR 1040N 0.96 0.14 0.03 1.57 1.13 -1.26 -1.35 117.35 118.57 1ce8 s TYR 1040Ca 0.74 -0.29 0.05 0.00 -1.41 0.00 0.00 57.07 56.15 1ce8 s TYR 1040Cb -0.52 -0.11 -0.03 0.00 -1.10 0.00 0.00 41.96 40.20 1ce8 s TYR 1040CO 0.35 -0.14 -0.10 -0.51 -2.51 0.00 0.00 175.55 172.64 1ce8 s ASP 1041N -0.94 4.36 -0.03 -0.18 1.01 0.74 -4.96 116.67 116.66 1ce8 s ASP 1041Ca -0.10 -0.25 0.10 0.00 0.71 0.00 0.00 52.55 53.01 1ce8 s ASP 1041Cb -0.06 -0.91 0.30 0.00 1.01 0.00 0.00 42.92 43.25 1ce8 s ASP 1041CO -0.00 0.26 1.25 0.35 0.21 0.00 0.00 175.17 177.24 1ce8 n THR 1042N 1.45 1.19 -3.92 -1.27 -2.24 -1.26 -1.86 114.28 106.37 1ce8 n THR 1042Ca -0.15 -1.14 -0.10 0.00 -2.27 0.00 0.00 64.05 60.38 1ce8 n THR 1042Cb 0.52 0.38 -0.12 0.00 -2.10 0.00 0.00 70.33 69.02 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 -1.28 0.07 0.15 4.28 -4.23 -1.26 -4.58 115.64 108.78 1ce8 s THR 1043Ca 0.23 -0.56 -0.12 0.00 -1.18 0.00 0.00 61.69 60.06 1ce8 s THR 1043Cb 0.14 -0.21 0.02 0.00 1.34 0.00 0.00 72.50 73.79 1ce8 s THR 1043CO 0.13 -0.31 1.60 0.25 -0.54 0.00 0.00 174.62 175.75 1ce8 h LEU 1044N 5.10 0.89 -0.81 4.79 5.85 -1.94 0.21 115.31 129.40 1ce8 h LEU 1044Ca -0.29 -0.32 0.05 0.00 0.84 0.00 0.00 57.88 58.16 1ce8 h LEU 1044Cb 1.21 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 41.94 1ce8 h LEU 1044CO 0.44 1.00 0.50 0.78 -0.34 0.00 0.00 178.44 180.81 1ce8 h ASN 1045N 0.77 0.80 -0.60 1.25 4.21 -1.97 0.32 115.58 120.35 1ce8 h ASN 1045Ca 0.14 0.01 -0.06 0.00 1.21 0.00 0.00 56.30 57.60 1ce8 h ASN 1045Cb 0.55 -0.16 -0.02 0.00 -1.12 0.00 0.00 38.32 37.57 1ce8 h ASN 1045CO 0.03 0.53 0.15 1.23 -1.29 0.00 0.00 177.43 178.07 1ce8 h GLY 1046N 0.93 1.04 0.73 2.83 0.00 -1.73 -1.60 103.07 105.28 1ce8 h GLY 1046Ca 0.34 -0.65 0.05 0.00 0.00 0.00 0.00 47.33 47.07 1ce8 h GLY 1046CO -0.15 0.61 0.34 -1.33 0.00 0.00 0.00 176.54 176.00 1ce8 h GLY 1047N 0.88 0.88 1.00 4.60 0.00 0.89 0.62 103.07 111.93 1ce8 h GLY 1047Ca 0.19 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 1ce8 h GLY 1047CO 0.00 0.16 0.35 0.74 0.00 0.00 0.00 176.54 177.80 1ce8 h PHE 1048N 0.64 0.78 -0.55 5.60 0.04 0.06 -1.80 116.94 121.72 1ce8 h PHE 1048Ca 0.27 -0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.96 1ce8 h PHE 1048Cb 0.14 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.01 1ce8 h PHE 1048CO -0.08 0.54 0.07 0.00 -0.60 0.00 0.00 178.31 178.24 1ce8 h ALA 1049N 1.18 0.73 -0.72 2.45 0.00 -1.00 -1.73 119.26 120.17 1ce8 h ALA 1049Ca 0.21 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1ce8 h ALA 1049Cb -0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 1ce8 h ALA 1049CO -0.04 0.49 0.47 1.15 0.00 0.00 0.00 179.25 181.33 1ce8 h THR 1050N 0.81 1.17 -0.43 0.00 2.02 -0.58 -1.35 112.91 114.55 1ce8 h THR 1050Ca 0.16 -0.33 -0.04 0.00 0.77 0.00 0.00 66.41 66.98 1ce8 h THR 1050Cb 0.44 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 1ce8 h THR 1050CO 0.01 0.17 0.11 0.00 0.37 0.00 0.00 175.52 176.19 1ce8 h ALA 1051N 1.27 1.39 -0.02 6.16 0.00 -0.97 -2.50 119.26 124.60 1ce8 h ALA 1051Ca 0.27 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1ce8 h ALA 1051Cb -0.09 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1ce8 h ALA 1051CO -0.07 0.44 0.00 0.52 0.00 0.00 0.00 179.25 180.15 1ce8 h MET 1052N 0.62 0.03 0.00 0.00 2.86 -0.78 -2.40 114.93 115.26 1ce8 h MET 1052Ca 0.14 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 1ce8 h MET 1052Cb 0.23 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.88 1ce8 h MET 1052CO -0.00 0.23 0.07 0.00 1.06 0.00 0.00 176.91 178.26 1ce8 h ALA 1053N 0.80 1.06 0.00 6.32 0.00 -0.83 -1.75 119.26 124.85 1ce8 h ALA 1053Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1ce8 h ALA 1053Cb 0.21 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1ce8 h ALA 1053CO -0.00 -0.06 -0.14 -0.07 0.00 0.00 0.00 179.25 178.98 1ce8 h LEU 1054N 0.00 0.00 -0.08 0.00 3.38 -1.11 -1.85 115.31 115.64 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 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1ce8 h LEU 1054CO 0.00 0.14 -0.06 0.59 0.09 0.00 0.00 178.44 179.20 1ce8 n ASN 1055N -3.93 0.19 -4.77 -0.43 5.03 -0.66 -4.89 115.26 105.80 1ce8 n ASN 1055Ca -0.02 -0.25 -0.23 0.00 0.87 0.00 0.00 54.58 54.94 1ce8 n ASN 1055Cb 0.23 -0.20 -0.06 0.00 -1.02 0.00 0.00 39.78 38.73 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 -2.59 3.69 -0.25 5.41 0.00 -0.70 -5.07 121.76 122.26 1ce8 s ALA 1056Ca 0.27 -1.97 -0.01 0.00 0.00 0.00 0.00 51.96 50.26 1ce8 s ALA 1056Cb 0.20 -0.65 0.07 0.00 0.00 0.00 0.00 23.12 22.74 1ce8 s ALA 1056CO 0.48 -0.12 0.02 0.34 0.00 0.00 0.00 175.76 176.48 1ce8 s ASP 1057N -3.95 3.66 0.54 0.00 -1.08 -1.26 -5.00 116.67 109.58 1ce8 s ASP 1057Ca 0.42 -1.23 0.32 0.00 -0.52 0.00 0.00 52.55 51.53 1ce8 s ASP 1057Cb 0.00 -0.95 1.39 0.00 -1.46 0.00 0.00 42.92 41.90 1ce8 s ASP 1057CO 0.24 -0.31 2.00 0.00 0.52 0.00 0.00 175.17 177.62 1ce8 h ALA 1058N 8.06 1.04 -0.50 3.66 0.00 -1.88 -2.57 119.26 127.07 1ce8 h ALA 1058Ca -0.15 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1ce8 h ALA 1058Cb 1.07 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1ce8 h ALA 1058CO 0.41 0.08 0.00 0.25 0.00 0.00 0.00 179.25 179.99 1ce8 n THR 1059N -3.23 1.34 -0.07 0.00 -2.24 -1.26 -4.43 114.28 104.40 1ce8 n THR 1059Ca -0.00 -0.88 -0.09 0.00 -2.27 0.00 0.00 64.05 60.81 1ce8 n THR 1059Cb 0.30 0.04 -0.06 0.00 -2.10 0.00 0.00 70.33 68.52 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 3.11 0.00 -5.97 -0.78 4.81 -1.87 -3.46 114.58 110.42 1ce8 h GLU 1060Ca 0.00 0.00 -0.59 0.00 -0.13 0.00 0.00 59.36 58.64 1ce8 h GLU 1060Cb 1.14 0.00 -0.29 0.00 0.63 0.00 0.00 28.75 30.23 1ce8 h GLU 1060CO 0.17 0.44 -0.85 0.21 -0.73 0.00 0.00 179.01 178.24 1ce8 s LYS 1061N -2.09 1.61 0.05 1.92 2.20 -1.26 -5.12 119.74 117.05 1ce8 s LYS 1061Ca -0.15 -0.74 0.08 0.00 -0.36 0.00 0.00 55.97 54.80 1ce8 s LYS 1061Cb 0.01 -1.57 -0.03 0.00 -1.51 0.00 0.00 37.83 34.73 1ce8 s LYS 1061CO 0.34 0.43 -0.23 0.14 -0.36 0.00 0.00 175.35 175.67 1ce8 s VAL 1062N -0.50 1.86 -0.03 4.02 -7.23 -1.26 -5.00 120.40 112.25 1ce8 s VAL 1062Ca 0.08 -1.28 -0.05 0.00 -1.81 0.00 0.00 61.98 58.92 1ce8 s VAL 1062Cb -0.08 -1.61 0.01 0.00 0.56 0.00 0.00 36.38 35.26 1ce8 s VAL 1062CO -0.01 0.27 0.12 -0.51 -0.31 0.00 0.00 175.10 174.66 1ce8 s ILE 1063N -0.80 0.02 0.25 -0.62 2.07 -1.26 -5.10 121.20 115.76 1ce8 s ILE 1063Ca 0.09 -0.20 -0.13 0.00 -1.41 0.00 0.00 60.65 59.00 1ce8 s ILE 1063Cb -0.09 -0.24 -0.08 0.00 0.13 0.00 0.00 42.46 42.17 1ce8 s ILE 1063CO 0.02 -0.11 0.63 -0.94 -1.91 0.00 0.00 174.94 172.63 1ce8 s SER 1064N -0.34 6.73 0.35 4.50 1.04 -1.26 -4.35 113.70 120.38 1ce8 s SER 1064Ca -0.04 1.11 0.03 0.00 0.48 0.00 0.00 55.95 57.52 1ce8 s SER 1064Cb -0.03 -2.30 0.65 0.00 0.10 0.00 0.00 66.02 64.44 1ce8 s SER 1064CO 0.00 -0.09 1.99 0.58 0.98 0.00 0.00 173.24 176.70 1ce8 h VAL 1065N 2.14 1.16 -0.28 5.02 2.07 -0.15 0.27 116.25 126.49 1ce8 h VAL 1065Ca -0.47 -0.37 -0.00 0.00 0.82 0.00 0.00 66.70 66.67 1ce8 h VAL 1065Cb 1.18 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 1ce8 h VAL 1065CO 0.67 0.17 0.17 1.56 0.02 0.00 0.00 177.57 180.16 1ce8 h GLN 1066N 0.77 0.38 -0.02 1.57 7.50 -1.89 0.54 115.11 123.97 1ce8 h GLN 1066Ca 0.20 -0.04 0.00 0.00 0.50 0.00 0.00 58.65 59.32 1ce8 h GLN 1066Cb -0.02 -0.08 -0.00 0.00 0.05 0.00 0.00 27.48 27.43 1ce8 h GLN 1066CO -0.04 0.30 0.01 0.93 -1.50 0.00 0.00 178.83 178.54 1ce8 h GLU 1067N 0.35 0.02 -0.49 1.46 5.08 -1.68 -1.75 114.58 117.57 1ce8 h GLU 1067Ca 0.10 -0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.53 1ce8 h GLU 1067Cb 0.02 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.21 1ce8 h GLU 1067CO -0.02 0.03 0.16 0.52 -1.00 0.00 0.00 179.01 178.70 1ce8 h MET 1068N 0.00 0.31 -0.59 2.33 2.86 -0.82 -1.78 114.93 117.25 1ce8 h MET 1068Ca 0.01 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 1ce8 h MET 1068Cb 0.02 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.58 1ce8 h MET 1068CO -0.00 0.21 0.31 0.45 1.06 0.00 0.00 176.91 178.94 1ce8 h HIS 1069N 0.32 0.80 0.00 -0.22 3.86 -0.65 -1.69 115.15 117.57 1ce8 h HIS 1069Ca 0.24 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.44 1ce8 h HIS 1069Cb 0.27 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 28.48 1ce8 h HIS 1069CO -0.18 0.57 0.00 0.00 0.86 0.00 0.00 177.93 179.19 1ce8 n ALA 1070N -2.45 1.74 1.48 2.45 0.00 -0.68 -2.31 120.51 120.75 1ce8 n ALA 1070Ca 0.05 0.05 0.14 0.00 0.00 0.00 0.00 53.44 53.69 1ce8 n ALA 1070Cb 0.11 -1.38 0.64 0.00 0.00 0.00 0.00 19.45 18.82 1ce8 n ALA 1070CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1ce8 n GLN 1071N -2.13 0.82 -3.16 0.00 6.02 -0.64 -4.89 117.38 113.40 1ce8 n GLN 1071Ca 0.03 -0.28 -0.39 0.00 -0.01 0.00 0.00 57.00 56.35 1ce8 n GLN 1071Cb 0.25 -1.49 -0.05 0.00 1.02 0.00 0.00 30.24 29.96 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 -2.37 5.04 -1.14 5.09 1.01 -0.98 -4.73 121.20 123.12 1ce8 s ILE 1072Ca 0.32 1.26 0.09 0.00 0.00 0.00 0.00 60.65 62.32 1ce8 s ILE 1072Cb 0.20 -3.95 0.07 0.00 0.01 0.00 0.00 42.46 38.79 1ce8 s ILE 1072CO 0.45 0.32 0.79 0.29 0.00 0.00 0.00 174.94 176.79