#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ui8 s SER 10 N 0.00 6.64 0.00 0.00 0.15 -1.26 -4.92 113.70 114.31 1ui8 s SER 10 Ca 0.00 1.89 0.14 0.00 0.70 0.00 0.00 55.95 58.68 1ui8 s SER 10 Cb 0.00 -2.56 0.66 0.00 -1.71 0.00 0.00 66.02 62.41 1ui8 s SER 10 CO 0.00 -0.57 1.41 -2.65 1.20 0.00 0.00 173.24 172.63 1ui8 n PRO 11 N -0.60 0.11 -0.26 5.44 -0.02 -1.26 -2.13 135.00 136.28 1ui8 n PRO 11 Ca 0.07 0.20 0.08 0.00 -2.02 0.00 0.00 63.50 61.83 1ui8 n PRO 11 Cb 0.52 -1.50 0.22 0.00 -0.02 0.00 0.00 33.50 32.72 1ui8 n PRO 11 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1ui8 n PHE 12 N -1.38 0.67 -1.19 6.00 3.72 -1.26 -4.69 117.46 119.33 1ui8 n PHE 12 Ca 0.05 -0.50 -0.32 0.00 -0.05 0.00 0.00 57.45 56.63 1ui8 n PHE 12 Cb 0.14 -0.02 0.11 0.00 -0.94 0.00 0.00 39.48 38.77 1ui8 n PHE 12 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 1ui8 s ARG 13 N -1.01 1.86 0.53 -1.08 1.70 -0.91 -4.77 118.95 115.27 1ui8 s ARG 13 Ca 0.34 1.54 -0.20 0.00 -0.47 0.00 0.00 55.73 56.93 1ui8 s ARG 13 Cb 0.18 -1.82 -0.06 0.00 -0.57 0.00 0.00 34.95 32.67 1ui8 s ARG 13 CO 0.23 -2.00 1.14 -0.51 -1.08 0.00 0.00 175.30 173.08 1ui8 s LEU 14 N -5.74 3.80 0.41 -1.89 1.43 -1.26 -4.98 118.68 110.44 1ui8 s LEU 14 Ca 0.69 2.21 -0.26 0.00 -1.03 0.00 0.00 54.13 55.74 1ui8 s LEU 14 Cb -0.24 -4.51 -0.09 0.00 0.03 0.00 0.00 46.19 41.39 1ui8 s LEU 14 CO 0.51 -1.17 1.34 0.00 0.23 0.00 0.00 176.35 177.26 1ui8 s ALA 15 N -1.71 3.28 0.34 4.21 0.00 -1.26 -5.03 121.76 121.59 1ui8 s ALA 15 Ca 0.71 1.30 0.04 0.00 0.00 0.00 0.00 51.96 54.01 1ui8 s ALA 15 Cb -0.25 -3.51 -0.02 0.00 0.00 0.00 0.00 23.12 19.34 1ui8 s ALA 15 CO 0.29 -0.90 0.49 -1.54 0.00 0.00 0.00 175.76 174.11 1ui8 s SER 16 N -0.65 6.06 0.22 0.00 1.04 -1.26 -4.51 113.70 114.60 1ui8 s SER 16 Ca 0.57 0.04 -0.08 0.00 0.48 0.00 0.00 55.95 56.96 1ui8 s SER 16 Cb -0.40 -1.53 0.25 0.00 0.10 0.00 0.00 66.02 64.45 1ui8 s SER 16 CO 0.51 -0.39 1.84 0.00 0.98 0.00 0.00 173.24 176.18 1ui8 h ALA 17 N 0.84 1.01 -0.90 5.32 0.00 -1.95 -2.26 119.26 121.32 1ui8 h ALA 17 Ca -0.48 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.46 1ui8 h ALA 17 Cb 1.25 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.78 1ui8 h ALA 17 CO 0.57 0.20 0.58 0.78 0.00 0.00 0.00 179.25 181.37 1ui8 h GLY 18 N 0.86 1.31 1.61 0.00 0.00 -1.99 -0.54 103.07 104.32 1ui8 h GLY 18 Ca 0.32 -0.44 -0.07 0.00 0.00 0.00 0.00 47.33 47.14 1ui8 h GLY 18 CO -0.15 0.36 -0.14 0.83 0.00 0.00 0.00 176.54 177.45 1ui8 h GLU 19 N 1.11 0.47 -0.23 4.80 5.08 -1.81 0.10 114.58 124.10 1ui8 h GLU 19 Ca 0.36 -0.14 -0.11 0.00 -1.00 0.00 0.00 59.36 58.47 1ui8 h GLU 19 Cb 0.03 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 1ui8 h GLU 19 CO -0.13 0.60 -0.30 0.82 -1.00 0.00 0.00 179.01 179.01 1ui8 h ILE 20 N 0.43 1.32 -0.40 3.13 2.04 -0.95 -2.06 117.51 121.03 1ui8 h ILE 20 Ca 0.08 -1.49 -0.02 0.00 1.00 0.00 0.00 64.86 64.43 1ui8 h ILE 20 Cb 0.50 1.74 -0.02 0.00 -0.74 0.00 0.00 36.82 38.30 1ui8 h ILE 20 CO 0.03 0.47 0.17 0.28 0.00 0.00 0.00 178.15 179.10 1ui8 h SER 21 N 0.31 0.50 -0.37 1.72 0.02 -0.86 -1.51 113.55 113.35 1ui8 h SER 21 Ca 0.03 -0.04 -0.09 0.00 -0.84 0.00 0.00 61.79 60.85 1ui8 h SER 21 Cb 0.87 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.27 1ui8 h SER 21 CO 0.07 0.44 -0.08 -0.08 -1.14 0.00 0.00 176.83 176.05 1ui8 h GLU 22 N 0.56 0.79 -0.44 3.45 4.57 -0.79 -0.62 114.58 122.10 1ui8 h GLU 22 Ca 0.14 -0.25 -0.11 0.00 -1.18 0.00 0.00 59.36 57.95 1ui8 h GLU 22 Cb 0.09 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.60 1ui8 h GLU 22 CO -0.02 0.85 -0.17 0.28 -1.18 0.00 0.00 179.01 178.77 1ui8 h VAL 23 N 0.73 1.27 0.04 0.32 2.07 -0.62 -1.40 116.25 118.66 1ui8 h VAL 23 Ca 0.13 -1.31 0.01 0.00 0.82 0.00 0.00 66.70 66.35 1ui8 h VAL 23 Cb 0.55 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 1ui8 h VAL 23 CO 0.03 0.45 -0.08 -0.61 0.02 0.00 0.00 177.57 177.37 1ui8 h GLN 24 N 0.73 -0.16 -0.23 1.57 4.15 -0.96 -0.52 115.11 119.67 1ui8 h GLN 24 Ca 0.10 0.01 0.03 0.00 0.77 0.00 0.00 58.65 59.57 1ui8 h GLN 24 Cb 0.73 0.04 -0.03 0.00 0.21 0.00 0.00 27.48 28.42 1ui8 h GLN 24 CO 0.06 -0.11 0.03 0.78 -1.93 0.00 0.00 178.83 177.66 1ui8 h GLY 25 N -0.17 0.25 0.81 2.39 0.00 -1.02 0.23 103.07 105.56 1ui8 h GLY 25 Ca 0.02 -0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.38 1ui8 h GLY 25 CO -0.06 -0.02 0.37 -2.22 0.00 0.00 0.00 176.54 174.62 1ui8 h ILE 26 N 0.12 1.04 -0.21 2.60 2.04 -1.07 -0.32 117.51 121.71 1ui8 h ILE 26 Ca 0.11 -0.25 -0.04 0.00 1.00 0.00 0.00 64.86 65.69 1ui8 h ILE 26 Cb 0.12 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.45 1ui8 h ILE 26 CO -0.16 0.13 -0.01 -0.07 0.00 0.00 0.00 178.15 178.04 1ui8 h LEU 27 N 0.72 0.37 0.08 1.44 3.38 -0.72 -1.38 115.31 119.20 1ui8 h LEU 27 Ca 0.26 -0.33 0.02 0.00 0.09 0.00 0.00 57.88 57.92 1ui8 h LEU 27 Cb 0.07 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 1ui8 h LEU 27 CO -0.13 0.61 -0.21 0.03 0.09 0.00 0.00 178.44 178.83 1ui8 h ARG 28 N 0.12 -0.36 -1.00 1.13 3.08 -0.69 0.12 114.38 116.79 1ui8 h ARG 28 Ca 0.06 0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.21 1ui8 h ARG 28 Cb 0.43 0.08 -0.07 0.00 0.08 0.00 0.00 29.97 30.49 1ui8 h ARG 28 CO 0.01 -0.24 0.64 1.15 -1.07 0.00 0.00 179.97 180.47 1ui8 h THR 29 N -0.37 1.04 0.00 2.04 2.02 -1.05 0.32 112.91 116.91 1ui8 h THR 29 Ca 0.04 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 66.83 1ui8 h THR 29 Cb 0.41 -0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.64 1ui8 h THR 29 CO -0.14 0.20 0.00 0.00 0.37 0.00 0.00 175.52 175.96 1ui8 n ALA 30 N -2.36 2.48 -2.02 6.16 0.00 -0.52 -4.86 120.51 119.39 1ui8 n ALA 30 Ca 0.16 -0.16 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 1ui8 n ALA 30 Cb 0.24 -1.44 -0.01 0.00 0.00 0.00 0.00 19.45 18.24 1ui8 n ALA 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ui8 n GLY 31 N 0.73 0.18 0.81 0.00 0.00 0.11 -4.93 105.19 102.09 1ui8 n GLY 31 Ca 0.19 -0.59 0.10 0.00 0.00 0.00 0.00 46.02 45.72 1ui8 n GLY 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ui8 n LEU 32 N -1.04 2.71 -2.65 0.99 4.77 0.36 -4.55 117.00 117.59 1ui8 n LEU 32 Ca -0.09 -1.08 -0.22 0.00 -0.03 0.00 0.00 56.01 54.59 1ui8 n LEU 32 Cb 0.53 -0.03 -0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1ui8 n LEU 32 CO 0.10 0.49 0.08 -0.11 -1.33 0.00 0.00 177.39 176.62 1ui8 n LEU 33 N 1.11 3.60 0.00 2.23 7.94 -1.22 -4.92 117.00 125.75 1ui8 n LEU 33 Ca 0.12 -4.91 -0.29 0.00 -1.11 0.00 0.00 56.01 49.83 1ui8 n LEU 33 Cb 0.49 -0.17 0.25 0.00 0.53 0.00 0.00 43.42 44.52 1ui8 n LEU 33 CO 0.12 2.10 0.54 0.61 -1.11 0.00 0.00 177.39 179.65 1ui8 n GLY 34 N -0.29 -2.97 0.35 -3.96 0.00 -1.26 -4.84 105.19 92.22 1ui8 n GLY 34 Ca 0.29 -1.46 0.17 0.00 0.00 0.00 0.00 46.02 45.03 1ui8 n GLY 34 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ui8 h PRO 35 N 0.00 0.03 -0.02 1.61 0.11 -2.00 -1.72 132.00 130.01 1ui8 h PRO 35 Ca -0.39 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1ui8 h PRO 35 Cb 1.21 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1ui8 h PRO 35 CO 0.25 0.02 -0.06 0.39 -0.21 0.00 0.00 178.00 178.39 1ui8 n GLU 36 N -4.42 1.62 -3.40 1.05 -0.58 -1.26 -4.93 120.64 108.71 1ui8 n GLU 36 Ca 0.07 -1.04 -0.33 0.00 -0.42 0.00 0.00 57.16 55.44 1ui8 n GLU 36 Cb 0.47 -1.48 -0.05 0.00 -0.57 0.00 0.00 31.44 29.81 1ui8 n GLU 36 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1ui8 s LYS 37 N -2.09 3.84 -0.05 3.49 -0.14 -0.65 -0.06 119.74 124.08 1ui8 s LYS 37 Ca 0.34 0.33 -0.04 0.00 -1.36 0.00 0.00 55.97 55.23 1ui8 s LYS 37 Cb 0.20 -2.72 0.02 0.00 -1.68 0.00 0.00 37.83 33.66 1ui8 s LYS 37 CO 0.37 0.36 0.13 1.03 -0.76 0.00 0.00 175.35 176.48 1ui8 s ARG 38 N -2.59 0.13 -0.50 1.68 1.81 -0.11 -4.87 118.95 114.49 1ui8 s ARG 38 Ca 0.45 0.24 -0.26 0.00 -1.72 0.00 0.00 55.73 54.44 1ui8 s ARG 38 Cb -0.12 -0.01 0.03 0.00 -0.45 0.00 0.00 34.95 34.40 1ui8 s ARG 38 CO 0.21 -0.07 0.99 0.42 -0.68 0.00 0.00 175.30 176.17 1ui8 s ILE 39 N 0.45 4.36 -0.54 1.52 1.01 0.85 -0.24 121.20 128.60 1ui8 s ILE 39 Ca -0.03 0.73 0.24 0.00 0.00 0.00 0.00 60.65 61.59 1ui8 s ILE 39 Cb -0.05 -4.52 0.22 0.00 0.01 0.00 0.00 42.46 38.13 1ui8 s ILE 39 CO -0.02 -0.98 1.53 0.00 0.00 0.00 0.00 174.94 175.46 1ui8 h ALA 40 N 9.21 0.85 -1.59 9.38 0.00 -1.35 -3.40 119.26 132.37 1ui8 h ALA 40 Ca -0.24 0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.73 1ui8 h ALA 40 Cb 1.07 0.00 -0.26 0.00 0.00 0.00 0.00 17.79 18.60 1ui8 h ALA 40 CO 1.07 0.00 0.45 -0.47 0.00 0.00 0.00 179.25 180.30 1ui8 s TYR 41 N -3.19 -0.49 -0.11 0.00 5.04 -1.21 -4.69 117.35 112.69 1ui8 s TYR 41 Ca 0.07 1.15 -0.06 0.00 -2.44 0.00 0.00 57.07 55.79 1ui8 s TYR 41 Cb 0.10 0.37 0.05 0.00 0.35 0.00 0.00 41.96 42.82 1ui8 s TYR 41 CO 0.67 -0.24 0.27 -1.17 -1.34 0.00 0.00 175.55 173.74 1ui8 s LEU 42 N 0.39 0.35 -0.14 6.97 0.20 -1.26 -0.95 118.68 124.24 1ui8 s LEU 42 Ca 0.02 0.57 -0.27 0.00 0.69 0.00 0.00 54.13 55.13 1ui8 s LEU 42 Cb -0.05 0.81 0.07 0.00 -0.43 0.00 0.00 46.19 46.59 1ui8 s LEU 42 CO -0.08 -0.17 0.67 -0.83 -0.29 0.00 0.00 176.35 175.65 1ui8 s GLY 43 N 1.28 -0.53 0.38 7.98 0.00 -0.33 -4.61 107.32 111.48 1ui8 s GLY 43 Ca -0.09 1.54 -0.26 0.00 0.00 0.00 0.00 44.72 45.90 1ui8 s GLY 43 CO -0.09 1.22 1.21 0.54 0.00 0.00 0.00 173.10 175.98 1ui8 s VAL 44 N -0.55 3.01 0.07 1.40 0.11 -1.26 -0.59 120.40 122.60 1ui8 s VAL 44 Ca -0.07 0.90 -0.20 0.00 -2.93 0.00 0.00 61.98 59.68 1ui8 s VAL 44 Cb -0.02 -3.53 -0.07 0.00 -1.53 0.00 0.00 36.38 31.24 1ui8 s VAL 44 CO 0.06 0.13 0.60 -0.76 -3.33 0.00 0.00 175.10 171.79 1ui8 s LEU 45 N -2.29 4.52 0.52 2.54 1.02 0.93 -4.84 118.68 121.09 1ui8 s LEU 45 Ca 0.55 1.30 -0.20 0.00 0.02 0.00 0.00 54.13 55.80 1ui8 s LEU 45 Cb -0.34 -2.95 -0.07 0.00 0.02 0.00 0.00 46.19 42.85 1ui8 s LEU 45 CO 0.43 0.24 1.08 -1.81 0.02 0.00 0.00 176.35 176.32 1ui8 s ASP 46 N -0.99 6.00 0.38 2.29 1.01 -1.26 -4.65 116.67 119.45 1ui8 s ASP 46 Ca 0.30 2.05 -0.28 0.00 0.71 0.00 0.00 52.55 55.33 1ui8 s ASP 46 Cb -0.20 -2.57 -0.11 0.00 1.01 0.00 0.00 42.92 41.05 1ui8 s ASP 46 CO 0.20 -1.02 1.49 -2.65 0.21 0.00 0.00 175.17 173.40 1ui8 n PRO 47 N -1.18 2.68 -1.04 8.23 -0.02 -1.26 -4.97 135.00 137.43 1ui8 n PRO 47 Ca 0.10 0.94 -0.29 0.00 -2.02 0.00 0.00 63.50 62.23 1ui8 n PRO 47 Cb 0.52 -2.67 0.18 0.00 -0.02 0.00 0.00 33.50 31.50 1ui8 n PRO 47 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ui8 s ALA 48 N -1.10 0.93 0.23 3.55 0.00 -1.26 -4.96 121.76 119.15 1ui8 s ALA 48 Ca 0.53 -0.16 -0.31 0.00 0.00 0.00 0.00 51.96 52.02 1ui8 s ALA 48 Cb -0.48 -3.19 -0.11 0.00 0.00 0.00 0.00 23.12 19.35 1ui8 s ALA 48 CO 0.64 -2.85 1.58 1.03 0.00 0.00 0.00 175.76 176.16 1ui8 s ARG 49 N -4.84 4.18 -1.22 0.00 1.81 -1.26 -3.00 118.95 114.61 1ui8 s ARG 49 Ca 0.65 2.46 -0.06 0.00 -1.72 0.00 0.00 55.73 57.06 1ui8 s ARG 49 Cb -0.20 -3.09 0.01 0.00 -0.45 0.00 0.00 34.95 31.22 1ui8 s ARG 49 CO 0.59 -0.60 0.84 0.41 -0.68 0.00 0.00 175.30 175.86 1ui8 n GLY 50 N 3.03 -0.33 1.67 -3.53 0.00 -1.26 -4.90 105.19 99.86 1ui8 n GLY 50 Ca 0.11 0.08 -0.10 0.00 0.00 0.00 0.00 46.02 46.11 1ui8 n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ui8 n ALA 51 N -4.18 4.45 -0.78 4.61 0.00 -1.16 -4.58 120.51 118.86 1ui8 n ALA 51 Ca -0.03 -1.03 -0.08 0.00 0.00 0.00 0.00 53.44 52.31 1ui8 n ALA 51 Cb 0.57 -1.22 -0.06 0.00 0.00 0.00 0.00 19.45 18.74 1ui8 n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ui8 n GLY 52 N 0.60 2.94 0.62 0.00 0.00 -1.26 -3.70 105.19 104.39 1ui8 n GLY 52 Ca 0.19 -0.65 0.07 0.00 0.00 0.00 0.00 46.02 45.63 1ui8 n GLY 52 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ui8 n SER 53 N 1.71 2.46 -0.54 1.61 2.88 -1.26 -4.97 113.62 115.50 1ui8 n SER 53 Ca 0.21 -1.71 -0.03 0.00 -1.33 0.00 0.00 58.87 56.02 1ui8 n SER 53 Cb 0.66 -0.09 -0.01 0.00 -0.75 0.00 0.00 64.21 64.02 1ui8 n SER 53 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1ui8 n GLU 54 N 0.76 -1.61 0.04 -1.46 4.71 -1.24 -4.72 120.64 117.11 1ui8 n GLU 54 Ca 0.10 0.26 0.01 0.00 -0.01 0.00 0.00 57.16 57.52 1ui8 n GLU 54 Cb 0.38 -3.83 0.34 0.00 -1.01 0.00 0.00 31.44 27.32 1ui8 n GLU 54 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1ui8 h ALA 55 N 0.63 1.45 -5.52 0.62 0.00 -1.93 -3.48 119.26 111.03 1ui8 h ALA 55 Ca -0.06 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 1ui8 h ALA 55 Cb 0.36 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ui8 h ALA 55 CO 0.09 0.39 -0.81 -1.91 0.00 0.00 0.00 179.25 177.01 1ui8 n GLU 56 N -4.30 -2.49 -3.61 0.00 4.07 -1.26 -4.96 120.64 108.10 1ui8 n GLU 56 Ca 0.01 2.12 -0.39 0.00 -0.06 0.00 0.00 57.16 58.84 1ui8 n GLU 56 Cb 0.23 -4.63 -0.08 0.00 -0.06 0.00 0.00 31.44 26.91 1ui8 n GLU 56 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 1ui8 s ASP 57 N -1.98 5.65 -0.49 4.31 2.15 -1.26 -4.90 116.67 120.15 1ui8 s ASP 57 Ca 0.16 -2.78 -0.28 0.00 0.43 0.00 0.00 52.55 50.08 1ui8 s ASP 57 Cb -0.04 -1.95 -0.00 0.00 -0.30 0.00 0.00 42.92 40.63 1ui8 s ASP 57 CO 0.71 -0.43 1.62 -0.13 -0.17 0.00 0.00 175.17 176.77 1ui8 s ARG 58 N 0.04 3.19 0.07 4.34 1.81 -1.26 -4.98 118.95 122.16 1ui8 s ARG 58 Ca 0.17 0.80 0.06 0.00 -1.72 0.00 0.00 55.73 55.04 1ui8 s ARG 58 Cb -0.18 -4.19 -0.04 0.00 -0.45 0.00 0.00 34.95 30.09 1ui8 s ARG 58 CO -0.05 -2.06 -0.08 1.03 -0.68 0.00 0.00 175.30 173.46 1ui8 s ARG 59 N 5.83 2.30 -0.00 3.54 0.52 -1.26 -1.23 118.95 128.64 1ui8 s ARG 59 Ca 0.64 -0.92 0.06 0.00 -0.52 0.00 0.00 55.73 54.99 1ui8 s ARG 59 Cb -0.14 -2.38 -0.02 0.00 0.52 0.00 0.00 34.95 32.93 1ui8 s ARG 59 CO 0.27 0.54 -0.19 -0.06 0.02 0.00 0.00 175.30 175.88 1ui8 s PHE 60 N -1.15 1.68 -0.11 -0.53 0.40 0.15 -0.05 117.98 118.36 1ui8 s PHE 60 Ca 0.20 -0.33 -0.04 0.00 -0.60 0.00 0.00 56.93 56.17 1ui8 s PHE 60 Cb -0.11 -1.06 -0.04 0.00 0.51 0.00 0.00 43.02 42.32 1ui8 s PHE 60 CO 0.12 -0.01 0.04 0.50 0.70 0.00 0.00 175.22 176.57 1ui8 s ARG 61 N -0.57 3.30 -0.00 0.44 3.52 0.24 -0.94 118.95 124.94 1ui8 s ARG 61 Ca 0.07 -0.34 0.01 0.00 -0.13 0.00 0.00 55.73 55.33 1ui8 s ARG 61 Cb -0.07 -2.96 -0.00 0.00 -1.56 0.00 0.00 34.95 30.35 1ui8 s ARG 61 CO -0.00 0.61 -0.02 0.08 -0.81 0.00 0.00 175.30 175.16 1ui8 s VAL 62 N -0.61 0.17 -0.24 7.11 1.01 0.47 -1.19 120.40 127.12 1ui8 s VAL 62 Ca 0.11 -0.09 -0.06 0.00 0.00 0.00 0.00 61.98 61.94 1ui8 s VAL 62 Cb -0.12 -0.15 -0.01 0.00 0.00 0.00 0.00 36.38 36.09 1ui8 s VAL 62 CO 0.02 0.05 0.02 -0.36 0.00 0.00 0.00 175.10 174.83 1ui8 s PHE 63 N -0.03 3.03 -0.24 5.22 0.08 -0.12 -0.78 117.98 125.15 1ui8 s PHE 63 Ca 0.01 -0.73 -0.05 0.00 0.12 0.00 0.00 56.93 56.27 1ui8 s PHE 63 Cb -0.01 -2.18 -0.01 0.00 -0.57 0.00 0.00 43.02 40.25 1ui8 s PHE 63 CO -0.00 -0.47 0.00 0.42 -0.10 0.00 0.00 175.22 175.07 1ui8 s ILE 64 N 1.54 3.73 0.28 0.64 1.01 0.29 -0.92 121.20 127.76 1ui8 s ILE 64 Ca 0.06 -0.40 -0.01 0.00 0.00 0.00 0.00 60.65 60.29 1ui8 s ILE 64 Cb -0.15 -2.73 -0.04 0.00 0.01 0.00 0.00 42.46 39.55 1ui8 s ILE 64 CO 0.00 0.37 0.49 -2.28 0.00 0.00 0.00 174.94 173.52 1ui8 s HIS 65 N 1.53 3.49 -0.21 3.97 5.65 0.67 -1.49 115.29 128.89 1ui8 s HIS 65 Ca 0.06 0.40 -0.00 0.00 0.25 0.00 0.00 55.06 55.77 1ui8 s HIS 65 Cb -0.15 -1.92 0.06 0.00 -1.18 0.00 0.00 32.58 29.39 1ui8 s HIS 65 CO -0.01 0.23 -0.04 0.34 -0.65 0.00 0.00 174.74 174.61 1ui8 s ASP 66 N -3.55 3.47 0.29 9.88 -1.08 -1.26 -0.94 116.67 123.49 1ui8 s ASP 66 Ca 0.40 -1.00 0.24 0.00 -0.52 0.00 0.00 52.55 51.67 1ui8 s ASP 66 Cb -0.10 -1.03 1.07 0.00 -1.46 0.00 0.00 42.92 41.39 1ui8 s ASP 66 CO 0.32 -0.23 1.71 1.33 0.52 0.00 0.00 175.17 178.82 1ui8 n VAL 67 N 4.77 0.88 1.45 1.11 0.24 0.92 -1.71 118.33 125.98 1ui8 n VAL 67 Ca -0.12 0.39 0.14 0.00 -2.04 0.00 0.00 64.34 62.71 1ui8 n VAL 67 Cb 0.45 -1.35 0.62 0.00 -1.47 0.00 0.00 33.84 32.09 1ui8 n VAL 67 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1ui8 n SER 68 N -2.28 0.55 0.00 -1.34 3.41 -1.26 -4.90 113.62 107.79 1ui8 n SER 68 Ca 0.01 -0.70 0.00 0.00 -0.26 0.00 0.00 58.87 57.92 1ui8 n SER 68 Cb 0.17 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 1ui8 n SER 68 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ui8 n GLY 69 N 1.25 0.44 3.77 5.00 0.00 -0.70 -5.06 105.19 109.89 1ui8 n GLY 69 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 1ui8 n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ui8 s ALA 70 N -2.00 2.36 0.30 4.61 0.00 -1.25 -4.95 121.76 120.82 1ui8 s ALA 70 Ca 0.00 0.45 -0.30 0.00 0.00 0.00 0.00 51.96 52.11 1ui8 s ALA 70 Cb 0.00 -3.31 -0.12 0.00 0.00 0.00 0.00 23.12 19.69 1ui8 s ALA 70 CO 0.00 -1.51 1.48 0.54 0.00 0.00 0.00 175.76 176.27 1ui8 n ARG 71 N -2.89 2.43 -1.73 0.00 1.74 -1.26 -4.31 116.66 110.64 1ui8 n ARG 71 Ca 0.10 0.86 -0.29 0.00 -0.77 0.00 0.00 57.85 57.75 1ui8 n ARG 71 Cb 0.52 -2.57 0.10 0.00 -1.02 0.00 0.00 32.46 29.49 1ui8 n ARG 71 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1ui8 s PRO 72 N -0.91 1.78 0.03 5.56 0.04 -1.26 -4.78 135.00 135.46 1ui8 s PRO 72 Ca 0.62 0.27 0.00 0.00 0.04 0.00 0.00 61.00 61.93 1ui8 s PRO 72 Cb -0.55 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.06 1ui8 s PRO 72 CO 0.53 -1.75 -0.03 -0.65 0.04 0.00 0.00 177.00 175.14 1ui8 s GLN 73 N -5.40 0.38 -0.27 4.56 -0.21 -0.56 0.03 119.66 118.19 1ui8 s GLN 73 Ca 0.62 -0.73 -0.07 0.00 0.02 0.00 0.00 55.36 55.21 1ui8 s GLN 73 Cb -0.13 0.10 -0.01 0.00 1.00 0.00 0.00 33.01 33.97 1ui8 s GLN 73 CO 0.51 -0.05 0.06 -2.00 -2.12 0.00 0.00 175.29 171.69 1ui8 s GLU 74 N -1.89 3.35 -0.04 2.91 2.12 0.39 -0.55 118.70 124.99 1ui8 s GLU 74 Ca -0.12 -0.68 0.07 0.00 0.36 0.00 0.00 54.97 54.60 1ui8 s GLU 74 Cb -0.07 -3.31 -0.01 0.00 0.26 0.00 0.00 34.13 31.00 1ui8 s GLU 74 CO -0.02 -0.31 -0.24 0.08 -0.54 0.00 0.00 175.26 174.22 1ui8 s VAL 75 N 1.54 1.98 -0.18 3.70 1.01 0.04 -0.94 120.40 127.55 1ui8 s VAL 75 Ca 0.05 -1.04 -0.01 0.00 0.00 0.00 0.00 61.98 60.98 1ui8 s VAL 75 Cb -0.16 -1.66 0.00 0.00 0.00 0.00 0.00 36.38 34.56 1ui8 s VAL 75 CO 0.02 0.55 -0.14 -0.89 0.00 0.00 0.00 175.10 174.65 1ui8 s THR 76 N -0.31 2.65 0.22 3.92 2.01 0.06 -0.40 115.64 123.78 1ui8 s THR 76 Ca 0.02 -0.75 0.11 0.00 0.31 0.00 0.00 61.69 61.37 1ui8 s THR 76 Cb -0.12 -2.14 -0.05 0.00 0.01 0.00 0.00 72.50 70.20 1ui8 s THR 76 CO 0.02 0.50 -0.21 0.68 -0.69 0.00 0.00 174.62 174.91 1ui8 s VAL 77 N 1.12 2.47 -0.29 3.82 -7.23 -0.12 -0.23 120.40 119.94 1ui8 s VAL 77 Ca 0.01 -2.10 -0.03 0.00 -1.81 0.00 0.00 61.98 58.05 1ui8 s VAL 77 Cb -0.14 -2.22 0.03 0.00 0.56 0.00 0.00 36.38 34.61 1ui8 s VAL 77 CO -0.05 -0.19 0.01 -0.55 -0.31 0.00 0.00 175.10 174.01 1ui8 s SER 78 N -2.92 4.80 0.36 4.85 0.15 -0.21 -0.67 113.70 120.06 1ui8 s SER 78 Ca 0.24 -1.02 0.26 0.00 0.70 0.00 0.00 55.95 56.13 1ui8 s SER 78 Cb -0.07 -1.75 0.77 0.00 -1.71 0.00 0.00 66.02 63.26 1ui8 s SER 78 CO 0.12 -0.21 1.75 -0.37 1.20 0.00 0.00 173.24 175.72 1ui8 h VAL 79 N 6.21 0.00 -0.01 4.45 -1.51 -1.45 0.12 116.25 124.05 1ui8 h VAL 79 Ca -0.27 -0.62 -0.01 0.00 -1.23 0.00 0.00 66.70 64.56 1ui8 h VAL 79 Cb 1.09 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 31.83 1ui8 h VAL 79 CO 0.57 0.00 -0.04 0.74 -1.23 0.00 0.00 177.57 177.61 1ui8 h THR 80 N 0.00 1.49 0.00 7.19 2.02 -1.91 -3.29 112.91 118.41 1ui8 h THR 80 Ca 0.00 -1.49 0.00 0.00 0.77 0.00 0.00 66.41 65.69 1ui8 h THR 80 Cb 0.73 2.46 0.00 0.00 -1.74 0.00 0.00 68.15 69.60 1ui8 h THR 80 CO 0.00 0.39 -0.53 0.59 0.37 0.00 0.00 175.52 176.35 1ui8 n ASN 81 N -4.74 0.69 -2.15 4.18 3.02 -1.22 -4.97 115.26 110.07 1ui8 n ASN 81 Ca -0.09 0.16 -0.15 0.00 -0.03 0.00 0.00 54.58 54.48 1ui8 n ASN 81 Cb 0.33 0.03 0.03 0.00 -0.61 0.00 0.00 39.78 39.57 1ui8 n ASN 81 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ui8 n GLY 82 N 1.35 -0.06 3.44 7.41 0.00 0.35 -5.02 105.19 112.66 1ui8 n GLY 82 Ca 0.04 -0.17 -0.21 0.00 0.00 0.00 0.00 46.02 45.68 1ui8 n GLY 82 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ui8 s THR 83 N -3.02 1.10 -0.34 2.61 -4.23 -0.88 -4.95 115.64 105.92 1ui8 s THR 83 Ca 0.25 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.64 1ui8 s THR 83 Cb -0.11 -2.76 -0.01 0.00 1.34 0.00 0.00 72.50 70.96 1ui8 s THR 83 CO 0.31 0.00 0.21 -0.69 -0.54 0.00 0.00 174.62 173.91 1ui8 s VAL 84 N -3.35 5.01 0.05 2.29 1.01 -1.26 -1.04 120.40 123.11 1ui8 s VAL 84 Ca 0.36 -0.36 -0.07 0.00 0.00 0.00 0.00 61.98 61.91 1ui8 s VAL 84 Cb 0.08 -3.60 -0.30 0.00 0.00 0.00 0.00 36.38 32.56 1ui8 s VAL 84 CO 0.15 -0.02 1.05 0.40 0.00 0.00 0.00 175.10 176.68 1ui8 h ILE 85 N 5.58 1.38 -2.56 2.22 2.04 -0.94 -3.48 117.51 121.75 1ui8 h ILE 85 Ca -0.31 -2.92 -0.06 0.00 1.00 0.00 0.00 64.86 62.57 1ui8 h ILE 85 Cb 1.15 2.94 -0.17 0.00 -0.74 0.00 0.00 36.82 40.00 1ui8 h ILE 85 CO 0.64 0.86 0.07 -0.55 0.00 0.00 0.00 178.15 179.17 1ui8 s SER 86 N -7.24 -0.50 -0.29 1.72 0.15 -0.70 -4.97 113.70 101.88 1ui8 s SER 86 Ca -0.06 0.33 0.01 0.00 0.70 0.00 0.00 55.95 56.93 1ui8 s SER 86 Cb 0.06 0.50 0.18 0.00 -1.71 0.00 0.00 66.02 65.05 1ui8 s SER 86 CO 0.90 -0.68 0.53 0.00 1.20 0.00 0.00 173.24 175.19 1ui8 s ALA 87 N -2.03 -1.93 -0.05 5.45 0.00 -1.26 -0.76 121.76 121.18 1ui8 s ALA 87 Ca -0.07 1.20 0.05 0.00 0.00 0.00 0.00 51.96 53.13 1ui8 s ALA 87 Cb -0.01 -2.18 -0.02 0.00 0.00 0.00 0.00 23.12 20.91 1ui8 s ALA 87 CO 0.02 -1.53 -0.20 0.08 0.00 0.00 0.00 175.76 174.13 1ui8 s VAL 88 N 2.75 2.53 0.24 0.00 1.01 -0.12 -4.95 120.40 121.86 1ui8 s VAL 88 Ca 0.15 -0.91 -0.28 0.00 0.00 0.00 0.00 61.98 60.94 1ui8 s VAL 88 Cb -0.13 -1.95 -0.09 0.00 0.00 0.00 0.00 36.38 34.21 1ui8 s VAL 88 CO -0.23 0.58 0.90 -1.61 0.00 0.00 0.00 175.10 174.73 1ui8 s GLU 89 N -0.47 4.73 -0.10 2.72 2.02 -1.26 -0.47 118.70 125.88 1ui8 s GLU 89 Ca 0.06 1.37 -0.03 0.00 0.02 0.00 0.00 54.97 56.38 1ui8 s GLU 89 Cb -0.12 -3.18 -0.04 0.00 0.10 0.00 0.00 34.13 30.90 1ui8 s GLU 89 CO 0.01 0.49 0.04 -0.51 0.02 0.00 0.00 175.26 175.31 1ui8 s LEU 90 N -1.35 3.82 -0.83 1.80 1.43 0.10 -4.92 118.68 118.73 1ui8 s LEU 90 Ca 0.41 0.24 -0.13 0.00 -1.03 0.00 0.00 54.13 53.63 1ui8 s LEU 90 Cb -0.24 -1.89 0.22 0.00 0.03 0.00 0.00 46.19 44.31 1ui8 s LEU 90 CO 0.29 0.38 0.76 -0.62 0.23 0.00 0.00 176.35 177.39 1ui8 s ASP 91 N -0.90 6.65 0.49 2.29 3.68 -1.26 -4.29 116.67 123.33 1ui8 s ASP 91 Ca 0.14 -2.78 0.22 0.00 2.13 0.00 0.00 52.55 52.25 1ui8 s ASP 91 Cb -0.12 -2.17 1.28 0.00 -1.45 0.00 0.00 42.92 40.46 1ui8 s ASP 91 CO 0.03 -0.53 1.96 0.71 0.13 0.00 0.00 175.17 177.47 1ui8 h THR 92 N 4.74 0.74 0.00 1.71 1.35 -1.94 -0.57 112.91 118.94 1ui8 h THR 92 Ca 0.10 -0.05 -0.03 0.00 -0.55 0.00 0.00 66.41 65.89 1ui8 h THR 92 Cb 1.02 0.58 -0.00 0.00 -1.73 0.00 0.00 68.15 68.01 1ui8 h THR 92 CO 0.76 0.03 -0.12 0.00 -0.25 0.00 0.00 175.52 175.94 1ui8 h ALA 93 N 1.69 1.16 0.00 6.62 0.00 -1.88 0.23 119.26 127.08 1ui8 h ALA 93 Ca 0.31 -0.11 -0.41 0.00 0.00 0.00 0.00 54.91 54.70 1ui8 h ALA 93 Cb 1.01 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.72 1ui8 h ALA 93 CO -0.04 0.15 -2.25 0.00 0.00 0.00 0.00 179.25 177.11 1ui8 n ALA 94 N -2.23 1.12 0.60 0.00 0.00 -0.34 -4.67 120.51 114.98 1ui8 n ALA 94 Ca -0.01 -0.96 0.12 0.00 0.00 0.00 0.00 53.44 52.59 1ui8 n ALA 94 Cb 0.28 -0.06 0.16 0.00 0.00 0.00 0.00 19.45 19.83 1ui8 n ALA 94 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ui8 n THR 95 N -4.18 0.29 0.00 0.00 -2.24 -0.51 -4.90 114.28 102.74 1ui8 n THR 95 Ca -0.48 -0.64 0.00 0.00 -2.27 0.00 0.00 64.05 60.65 1ui8 n THR 95 Cb 0.86 1.21 0.00 0.00 -2.10 0.00 0.00 70.33 70.30 1ui8 n THR 95 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ui8 n GLY 96 N 1.42 1.53 3.88 3.38 0.00 0.80 -4.42 105.19 111.78 1ui8 n GLY 96 Ca 0.17 -1.76 -0.30 0.00 0.00 0.00 0.00 46.02 44.13 1ui8 n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ui8 s GLU 97 N -3.47 3.56 0.77 1.61 0.41 0.31 -4.38 118.70 117.50 1ui8 s GLU 97 Ca 0.00 0.60 -0.11 0.00 -0.41 0.00 0.00 54.97 55.05 1ui8 s GLU 97 Cb 0.00 -2.15 0.05 0.00 -1.78 0.00 0.00 34.13 30.25 1ui8 s GLU 97 CO 0.00 -0.50 1.08 -0.51 -0.49 0.00 0.00 175.26 174.85 1ui8 s LEU 98 N -5.08 2.79 0.53 1.80 1.02 -1.26 -3.87 118.68 114.61 1ui8 s LEU 98 Ca 0.53 1.47 -0.22 0.00 0.02 0.00 0.00 54.13 55.93 1ui8 s LEU 98 Cb -0.11 -4.16 -0.07 0.00 0.02 0.00 0.00 46.19 41.87 1ui8 s LEU 98 CO 0.52 -1.84 1.14 -2.65 0.02 0.00 0.00 176.35 173.53 1ui8 n PRO 99 N -3.37 1.37 -1.96 1.29 -0.02 -1.26 -4.74 135.00 126.31 1ui8 n PRO 99 Ca 0.07 0.50 -0.42 0.00 -2.02 0.00 0.00 63.50 61.64 1ui8 n PRO 99 Cb 0.55 -2.30 -0.03 0.00 -0.02 0.00 0.00 33.50 31.71 1ui8 n PRO 99 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ui8 s VAL 100 N -1.36 2.59 0.17 -1.45 1.01 -0.74 -4.92 120.40 115.71 1ui8 s VAL 100 Ca 0.70 0.46 -0.25 0.00 0.00 0.00 0.00 61.98 62.89 1ui8 s VAL 100 Cb -0.46 -3.29 -0.08 0.00 0.00 0.00 0.00 36.38 32.55 1ui8 s VAL 100 CO 0.51 0.06 0.76 -0.76 0.00 0.00 0.00 175.10 175.67 1ui8 s LEU 101 N 0.24 4.58 0.49 3.92 1.43 -1.26 -4.86 118.68 123.22 1ui8 s LEU 101 Ca 0.64 1.61 0.19 0.00 -1.03 0.00 0.00 54.13 55.54 1ui8 s LEU 101 Cb -0.43 -3.30 1.22 0.00 0.03 0.00 0.00 46.19 43.71 1ui8 s LEU 101 CO 0.39 0.20 2.02 -0.08 0.23 0.00 0.00 176.35 179.11 1ui8 h GLU 102 N 4.27 0.16 0.00 1.70 4.81 -1.96 0.28 114.58 123.85 1ui8 h GLU 102 Ca -0.47 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 58.73 1ui8 h GLU 102 Cb 1.21 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.55 1ui8 h GLU 102 CO 0.66 0.11 -0.08 1.05 -0.73 0.00 0.00 179.01 180.01 1ui8 h GLU 103 N 0.17 0.00 0.00 1.92 4.11 -2.03 -2.71 114.58 116.04 1ui8 h GLU 103 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.65 1ui8 h GLU 103 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1ui8 h GLU 103 CO -0.03 0.08 -0.14 0.39 0.07 0.00 0.00 179.01 179.38 1ui8 n GLU 104 N -3.20 0.26 0.02 1.06 1.02 0.08 -3.62 120.64 116.27 1ui8 n GLU 104 Ca 0.01 0.18 -0.05 0.00 -0.02 0.00 0.00 57.16 57.28 1ui8 n GLU 104 Cb 0.38 -1.77 0.17 0.00 -0.02 0.00 0.00 31.44 30.19 1ui8 n GLU 104 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 1ui8 h PHE 105 N 0.00 0.55 -0.33 -0.32 0.04 -1.45 -3.05 116.94 112.37 1ui8 h PHE 105 Ca 0.00 -0.14 -0.08 0.00 2.80 0.00 0.00 57.97 60.55 1ui8 h PHE 105 Cb 0.73 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.75 1ui8 h PHE 105 CO 0.00 0.75 -0.11 0.93 -0.60 0.00 0.00 178.31 179.28 1ui8 h GLU 106 N 0.41 0.66 -0.95 1.51 5.08 -1.71 -3.26 114.58 116.33 1ui8 h GLU 106 Ca 0.05 -0.26 0.26 0.00 -1.00 0.00 0.00 59.36 58.41 1ui8 h GLU 106 Cb 0.77 -0.03 -0.17 0.00 0.50 0.00 0.00 28.75 29.82 1ui8 h GLU 106 CO 0.06 0.84 0.10 0.28 -1.00 0.00 0.00 179.01 179.29 1ui8 h VAL 107 N 0.44 0.10 0.07 3.13 2.07 -1.67 -2.79 116.25 117.61 1ui8 h VAL 107 Ca 0.08 -0.02 0.02 0.00 0.82 0.00 0.00 66.70 67.61 1ui8 h VAL 107 Cb 0.62 0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 30.39 1ui8 h VAL 107 CO 0.04 0.01 -0.29 0.58 0.02 0.00 0.00 177.57 177.92 1ui8 h VAL 108 N 0.05 0.36 -0.43 2.57 2.07 -1.65 -0.36 116.25 118.85 1ui8 h VAL 108 Ca 0.59 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 68.10 1ui8 h VAL 108 Cb 1.23 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 1ui8 h VAL 108 CO -0.84 0.00 0.24 -0.08 0.02 0.00 0.00 177.57 176.91 1ui8 h GLU 109 N -0.48 0.60 -0.25 1.57 4.81 -1.71 -2.08 114.58 117.03 1ui8 h GLU 109 Ca 0.04 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 59.23 1ui8 h GLU 109 Cb 0.53 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 1ui8 h GLU 109 CO -0.21 0.47 0.09 1.96 -0.73 0.00 0.00 179.01 180.60 1ui8 h GLN 110 N 0.57 0.21 -0.35 1.92 4.20 -1.41 -1.56 115.11 118.68 1ui8 h GLN 110 Ca 0.15 -0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.81 1ui8 h GLN 110 Cb 0.04 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 1ui8 h GLN 110 CO -0.03 0.14 0.06 -0.07 -0.67 0.00 0.00 178.83 178.27 1ui8 h LEU 111 N 0.21 0.54 -1.52 1.46 3.38 -0.97 -3.02 115.31 115.39 1ui8 h LEU 111 Ca 0.11 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1ui8 h LEU 111 Cb 0.07 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1ui8 h LEU 111 CO -0.11 0.66 0.10 -0.07 0.09 0.00 0.00 178.44 179.11 1ui8 h LEU 112 N 0.41 0.38 -2.32 1.67 3.38 -1.20 -2.91 115.31 114.73 1ui8 h LEU 112 Ca 0.11 -0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.08 1ui8 h LEU 112 Cb 0.34 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1ui8 h LEU 112 CO 0.01 0.36 0.20 0.00 0.09 0.00 0.00 178.44 179.10 1ui8 h ALA 113 N 1.70 1.58 -0.18 1.53 0.00 -1.15 -0.76 119.26 121.98 1ui8 h ALA 113 Ca 0.10 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1ui8 h ALA 113 Cb 0.12 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1ui8 h ALA 113 CO -0.01 -0.26 0.00 0.25 0.00 0.00 0.00 179.25 179.23 1ui8 n THR 114 N -3.50 0.68 -2.99 0.00 -2.24 -1.10 -4.88 114.28 100.25 1ui8 n THR 114 Ca 0.00 -0.84 -0.40 0.00 -2.27 0.00 0.00 64.05 60.54 1ui8 n THR 114 Cb 0.30 0.71 -0.04 0.00 -2.10 0.00 0.00 70.33 69.19 1ui8 n THR 114 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ui8 s ASP 115 N -0.90 7.01 0.27 3.42 -1.08 -0.29 -4.96 116.67 120.14 1ui8 s ASP 115 Ca 0.14 1.22 -0.04 0.00 -0.52 0.00 0.00 52.55 53.35 1ui8 s ASP 115 Cb 0.08 -2.43 0.35 0.00 -1.46 0.00 0.00 42.92 39.46 1ui8 s ASP 115 CO 0.11 -0.18 1.94 -0.33 0.52 0.00 0.00 175.17 177.23 1ui8 h GLU 116 N 6.88 1.19 -0.53 4.34 5.08 -1.93 -0.51 114.58 129.09 1ui8 h GLU 116 Ca -0.39 -0.08 -0.03 0.00 -1.00 0.00 0.00 59.36 57.86 1ui8 h GLU 116 Cb 1.19 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 30.15 1ui8 h GLU 116 CO 0.77 0.80 0.20 0.00 -1.00 0.00 0.00 179.01 179.78 1ui8 h ARG 117 N 1.22 0.80 -0.19 2.33 3.08 -1.94 -0.29 114.38 119.38 1ui8 h ARG 117 Ca 0.33 -0.15 -0.03 0.00 0.07 0.00 0.00 59.98 60.20 1ui8 h ARG 117 Cb -0.11 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.80 1ui8 h ARG 117 CO -0.07 0.71 0.02 2.35 -1.07 0.00 0.00 179.97 181.91 1ui8 h TRP 118 N 0.72 0.36 -0.33 3.04 2.91 -1.75 -1.49 115.95 119.41 1ui8 h TRP 118 Ca 0.18 -0.06 -0.03 0.00 1.13 0.00 0.00 58.89 60.11 1ui8 h TRP 118 Cb 0.22 -0.10 -0.02 0.00 -0.51 0.00 0.00 29.16 28.75 1ui8 h TRP 118 CO 0.01 0.51 0.06 -0.07 -1.03 0.00 0.00 178.44 177.91 1ui8 h LEU 119 N 0.11 0.45 -0.45 0.65 3.38 -1.01 -1.17 115.31 117.26 1ui8 h LEU 119 Ca 0.06 -0.06 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 1ui8 h LEU 119 Cb 0.35 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1ui8 h LEU 119 CO 0.01 0.47 -0.14 0.50 0.09 0.00 0.00 178.44 179.37 1ui8 h LYS 120 N 0.48 0.89 -0.58 1.13 3.64 -0.80 -0.17 116.57 121.15 1ui8 h LYS 120 Ca 0.11 -0.35 -0.08 0.00 -1.27 0.00 0.00 60.65 59.06 1ui8 h LYS 120 Cb 0.22 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 1ui8 h LYS 120 CO 0.00 1.00 0.07 0.00 -2.27 0.00 0.00 179.45 178.24 1ui8 h ALA 121 N 0.86 0.78 -0.24 5.00 0.00 -0.76 -2.16 119.26 122.74 1ui8 h ALA 121 Ca 0.11 -0.27 -0.14 0.00 0.00 0.00 0.00 54.91 54.61 1ui8 h ALA 121 Cb 0.69 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1ui8 h ALA 121 CO 0.05 0.55 -0.44 -0.07 0.00 0.00 0.00 179.25 179.34 1ui8 h LEU 122 N 0.88 0.66 -0.69 0.00 3.38 -1.08 -3.09 115.31 115.37 1ui8 h LEU 122 Ca 0.17 -0.31 -0.07 0.00 0.09 0.00 0.00 57.88 57.77 1ui8 h LEU 122 Cb 0.46 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1ui8 h LEU 122 CO 0.02 1.01 0.17 0.00 0.09 0.00 0.00 178.44 179.73 1ui8 h ALA 123 N 1.02 0.91 0.00 1.53 0.00 -0.87 -0.38 119.26 121.47 1ui8 h ALA 123 Ca 0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1ui8 h ALA 123 Cb 0.97 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1ui8 h ALA 123 CO 0.09 0.63 -0.05 0.00 0.00 0.00 0.00 179.25 179.92 1ui8 h ALA 124 N 1.08 1.65 -0.09 0.00 0.00 -1.33 -1.42 119.26 119.15 1ui8 h ALA 124 Ca 0.22 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1ui8 h ALA 124 Cb 0.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1ui8 h ALA 124 CO 0.00 0.06 0.00 0.54 0.00 0.00 0.00 179.25 179.85 1ui8 n ARG 125 N -4.09 2.25 -3.59 0.00 1.74 -0.76 -4.96 116.66 107.24 1ui8 n ARG 125 Ca -0.03 -1.83 -0.25 0.00 -0.77 0.00 0.00 57.85 54.97 1ui8 n ARG 125 Cb 0.14 -1.47 0.06 0.00 -1.02 0.00 0.00 32.46 30.16 1ui8 n ARG 125 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1ui8 n ASN 126 N 1.18 -5.89 -4.56 0.55 3.02 -0.29 -4.98 115.26 104.29 1ui8 n ASN 126 Ca 0.16 -0.56 -0.35 0.00 -0.03 0.00 0.00 54.58 53.80 1ui8 n ASN 126 Cb 0.56 -4.67 -0.11 0.00 -0.61 0.00 0.00 39.78 34.95 1ui8 n ASN 126 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ui8 s LEU 127 N -7.20 3.56 -0.20 3.41 1.43 -0.41 -5.03 118.68 114.25 1ui8 s LEU 127 Ca 0.57 -0.04 -0.29 0.00 -1.03 0.00 0.00 54.13 53.34 1ui8 s LEU 127 Cb -0.26 -1.90 -0.03 0.00 0.03 0.00 0.00 46.19 44.04 1ui8 s LEU 127 CO 0.70 0.14 1.56 -0.62 0.23 0.00 0.00 176.35 178.35 1ui8 s ASP 128 N 0.58 6.51 0.51 2.29 -1.08 -1.26 -4.53 116.67 119.68 1ui8 s ASP 128 Ca 0.01 1.68 0.29 0.00 -0.52 0.00 0.00 52.55 54.02 1ui8 s ASP 128 Cb -0.13 -2.53 1.40 0.00 -1.46 0.00 0.00 42.92 40.20 1ui8 s ASP 128 CO 0.02 -1.14 1.86 1.62 0.52 0.00 0.00 175.17 178.05 1ui8 h VAL 129 N 5.97 0.54 0.00 1.11 3.04 -1.96 0.34 116.25 125.31 1ui8 h VAL 129 Ca -0.33 -0.03 0.00 0.00 -1.01 0.00 0.00 66.70 65.33 1ui8 h VAL 129 Cb 1.15 0.44 0.00 0.00 -2.01 0.00 0.00 31.29 30.87 1ui8 h VAL 129 CO 0.99 0.02 0.00 -1.54 -1.01 0.00 0.00 177.57 176.03 1ui8 n SER 130 N -4.32 0.12 -0.65 3.17 3.41 -1.26 -2.55 113.62 111.54 1ui8 n SER 130 Ca 0.20 0.52 0.08 0.00 -0.26 0.00 0.00 58.87 59.42 1ui8 n SER 130 Cb 0.96 -0.55 0.07 0.00 -0.26 0.00 0.00 64.21 64.43 1ui8 n SER 130 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ui8 n LYS 131 N -1.62 1.25 -3.35 4.33 5.02 0.12 -4.93 118.16 118.98 1ui8 n LYS 131 Ca 0.04 -1.47 -0.43 0.00 -2.02 0.00 0.00 58.31 54.43 1ui8 n LYS 131 Cb 0.22 -1.31 -0.08 0.00 -0.02 0.00 0.00 35.03 33.83 1ui8 n LYS 131 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ui8 s VAL 132 N -1.34 5.13 0.30 -0.18 1.01 -1.06 -0.56 120.40 123.72 1ui8 s VAL 132 Ca 0.19 -0.62 -0.22 0.00 0.00 0.00 0.00 61.98 61.33 1ui8 s VAL 132 Cb 0.13 -4.07 -0.09 0.00 0.00 0.00 0.00 36.38 32.35 1ui8 s VAL 132 CO 0.20 -0.49 0.85 -0.13 0.00 0.00 0.00 175.10 175.52 1ui8 s ARG 133 N 1.98 4.35 -0.14 2.72 1.81 0.68 -4.89 118.95 125.46 1ui8 s ARG 133 Ca 0.09 1.07 0.01 0.00 -1.72 0.00 0.00 55.73 55.18 1ui8 s ARG 133 Cb -0.20 -2.69 0.02 0.00 -0.45 0.00 0.00 34.95 31.63 1ui8 s ARG 133 CO 0.11 0.26 -0.17 0.08 -0.68 0.00 0.00 175.30 174.90 1ui8 s VAL 134 N -1.71 1.70 -0.37 3.52 1.01 -1.26 -0.87 120.40 122.42 1ui8 s VAL 134 Ca 0.50 -0.73 -0.29 0.00 0.00 0.00 0.00 61.98 61.46 1ui8 s VAL 134 Cb -0.16 -1.56 0.02 0.00 0.00 0.00 0.00 36.38 34.69 1ui8 s VAL 134 CO 0.20 0.48 1.08 0.00 0.00 0.00 0.00 175.10 176.87 1ui8 s ALA 135 N 1.22 3.38 -0.85 5.51 0.00 0.64 -4.72 121.76 126.95 1ui8 s ALA 135 Ca 0.00 -0.23 -0.23 0.00 0.00 0.00 0.00 51.96 51.50 1ui8 s ALA 135 Cb -0.14 -3.73 0.07 0.00 0.00 0.00 0.00 23.12 19.32 1ui8 s ALA 135 CO -0.07 -1.74 1.23 -1.25 0.00 0.00 0.00 175.76 173.93 1ui8 s PRO 136 N 3.89 3.38 0.10 0.00 0.04 -1.26 -2.21 135.00 138.93 1ui8 s PRO 136 Ca 0.45 -0.95 0.02 0.00 0.04 0.00 0.00 61.00 60.56 1ui8 s PRO 136 Cb -0.11 -4.71 -0.04 0.00 0.04 0.00 0.00 34.50 29.69 1ui8 s PRO 136 CO 0.21 -2.02 0.18 -0.51 0.04 0.00 0.00 177.00 174.90 1ui8 s LEU 137 N 4.51 4.12 0.64 -3.56 1.43 0.63 -4.90 118.68 121.55 1ui8 s LEU 137 Ca 0.35 0.11 -0.18 0.00 -1.03 0.00 0.00 54.13 53.38 1ui8 s LEU 137 Cb -0.07 -2.73 -0.01 0.00 0.03 0.00 0.00 46.19 43.40 1ui8 s LEU 137 CO 0.01 0.13 1.30 -0.94 0.23 0.00 0.00 176.35 177.08 1ui8 s SER 138 N -2.74 4.65 -0.02 2.29 1.04 -1.26 -0.55 113.70 117.12 1ui8 s SER 138 Ca 0.33 2.63 0.15 0.00 0.48 0.00 0.00 55.95 59.54 1ui8 s SER 138 Cb -0.12 -2.62 -0.20 0.00 0.10 0.00 0.00 66.02 63.18 1ui8 s SER 138 CO 0.26 -1.97 0.67 0.00 0.98 0.00 0.00 173.24 173.17 1ui8 n ALA 139 N -1.85 1.67 -0.52 5.32 0.00 -1.26 -4.56 120.51 119.31 1ui8 n ALA 139 Ca 0.16 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.87 1ui8 n ALA 139 Cb 0.48 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 19.10 1ui8 n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ui8 n GLY 140 N 1.51 -0.61 2.79 0.00 0.00 -1.26 -4.70 105.19 102.92 1ui8 n GLY 140 Ca -0.15 -1.10 -0.27 0.00 0.00 0.00 0.00 46.02 44.50 1ui8 n GLY 140 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ui8 s VAL 141 N 0.00 0.69 0.00 1.61 1.01 -1.26 -4.53 120.40 117.91 1ui8 s VAL 141 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.54 1ui8 s VAL 141 Cb 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 36.38 35.37 1ui8 s VAL 141 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 175.10 175.59 1ui8 n PHE 142 N 5.01 0.00 -0.05 5.22 3.72 -1.26 -4.90 117.46 125.21 1ui8 n PHE 142 Ca -0.09 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.41 1ui8 n PHE 142 Cb 0.48 0.00 0.29 0.00 -0.94 0.00 0.00 39.48 39.31 1ui8 n PHE 142 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 176.76 175.86 1ui8 n GLU 143 N 0.00 2.51 -2.97 -1.08 0.00 -1.26 -4.82 120.64 113.02 1ui8 n GLU 143 Ca 0.00 -2.34 -0.44 0.00 0.00 0.00 0.00 57.16 54.38 1ui8 n GLU 143 Cb 0.00 -1.51 -0.03 0.00 0.00 0.00 0.00 31.44 29.90 1ui8 n GLU 143 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 1ui8 s TYR 144 N -1.15 3.14 0.38 -1.84 2.02 -1.26 -4.88 117.35 113.76 1ui8 s TYR 144 Ca 0.43 -1.36 0.11 0.00 -0.37 0.00 0.00 57.07 55.89 1ui8 s TYR 144 Cb 0.23 -4.22 0.90 0.00 -0.40 0.00 0.00 41.96 38.47 1ui8 s TYR 144 CO 0.30 -1.44 1.90 0.00 -1.57 0.00 0.00 175.55 174.74 1ui8 h ALA 145 N 8.81 1.93 0.00 3.71 0.00 -2.01 -1.16 119.26 130.54 1ui8 h ALA 145 Ca 0.09 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1ui8 h ALA 145 Cb 1.03 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1ui8 h ALA 145 CO 1.08 -0.14 0.00 -0.85 0.00 0.00 0.00 179.25 179.34 1ui8 n GLU 146 N -4.52 0.16 0.07 0.00 0.00 -1.26 -2.37 120.64 112.71 1ui8 n GLU 146 Ca 0.15 0.18 0.11 0.00 0.00 0.00 0.00 57.16 57.61 1ui8 n GLU 146 Cb 0.46 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.41 1ui8 n GLU 146 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1ui8 n GLU 147 N -1.29 0.51 -1.70 3.44 1.02 -0.44 -4.77 120.64 117.41 1ui8 n GLU 147 Ca 0.05 0.05 -0.42 0.00 -0.02 0.00 0.00 57.16 56.82 1ui8 n GLU 147 Cb 0.09 -1.72 -0.03 0.00 -0.02 0.00 0.00 31.44 29.76 1ui8 n GLU 147 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1ui8 s ARG 148 N -3.33 3.88 0.00 3.49 0.52 -1.00 -0.95 118.95 121.57 1ui8 s ARG 148 Ca 0.00 2.40 0.00 0.00 -0.52 0.00 0.00 55.73 57.61 1ui8 s ARG 148 Cb 0.12 -4.20 0.00 0.00 0.52 0.00 0.00 34.95 31.39 1ui8 s ARG 148 CO 0.80 -1.24 0.00 0.41 0.02 0.00 0.00 175.30 175.29 1ui8 n GLY 149 N 4.82 1.18 3.86 -3.53 0.00 -1.26 -4.95 105.19 105.31 1ui8 n GLY 149 Ca 0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 1ui8 n GLY 149 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ui8 s ARG 150 N -0.85 3.20 -0.57 1.61 1.81 -0.12 -4.84 118.95 119.19 1ui8 s ARG 150 Ca 0.00 -0.59 -0.19 0.00 -1.72 0.00 0.00 55.73 53.23 1ui8 s ARG 150 Cb 0.00 -2.88 0.09 0.00 -0.45 0.00 0.00 34.95 31.70 1ui8 s ARG 150 CO 0.00 0.57 0.70 1.03 -0.68 0.00 0.00 175.30 176.92 1ui8 s ARG 151 N -2.62 3.08 0.03 3.54 0.52 -1.26 -4.99 118.95 117.24 1ui8 s ARG 151 Ca 0.33 -1.13 0.02 0.00 -0.52 0.00 0.00 55.73 54.42 1ui8 s ARG 151 Cb -0.12 -4.21 -0.04 0.00 0.52 0.00 0.00 34.95 31.10 1ui8 s ARG 151 CO 0.26 -1.45 0.05 0.42 0.02 0.00 0.00 175.30 174.59 1ui8 s ILE 152 N 2.78 4.41 -0.00 1.52 -1.09 -1.26 -1.31 121.20 126.25 1ui8 s ILE 152 Ca 0.14 -0.63 0.03 0.00 -2.23 0.00 0.00 60.65 57.95 1ui8 s ILE 152 Cb -0.22 -3.04 -0.01 0.00 -1.58 0.00 0.00 42.46 37.61 1ui8 s ILE 152 CO 0.09 0.27 -0.10 -0.76 -1.23 0.00 0.00 174.94 173.20 1ui8 s LEU 153 N -1.92 2.04 -0.03 2.97 1.43 -0.25 -4.15 118.68 118.75 1ui8 s LEU 153 Ca 0.24 -0.21 0.00 0.00 -1.03 0.00 0.00 54.13 53.14 1ui8 s LEU 153 Cb -0.12 -0.51 -0.03 0.00 0.03 0.00 0.00 46.19 45.56 1ui8 s LEU 153 CO 0.15 0.11 -0.01 -0.13 0.23 0.00 0.00 176.35 176.71 1ui8 s ARG 154 N -0.33 2.84 -0.04 1.70 0.52 0.29 -0.52 118.95 123.41 1ui8 s ARG 154 Ca 0.03 -0.54 0.06 0.00 -0.52 0.00 0.00 55.73 54.76 1ui8 s ARG 154 Cb -0.04 -2.70 -0.01 0.00 0.52 0.00 0.00 34.95 32.72 1ui8 s ARG 154 CO -0.00 0.65 -0.24 0.20 0.02 0.00 0.00 175.30 175.93 1ui8 s GLY 155 N -1.27 1.20 -0.05 -3.53 0.00 0.39 -0.27 107.32 103.79 1ui8 s GLY 155 Ca 0.17 -1.00 0.06 0.00 0.00 0.00 0.00 44.72 43.95 1ui8 s GLY 155 CO 0.07 -0.69 -0.23 1.08 0.00 0.00 0.00 173.10 173.33 1ui8 s LEU 156 N -0.29 2.20 0.05 0.66 1.43 -0.94 -2.43 118.68 119.36 1ui8 s LEU 156 Ca 0.01 -0.45 -0.09 0.00 -1.03 0.00 0.00 54.13 52.57 1ui8 s LEU 156 Cb -0.12 -1.41 -0.05 0.00 0.03 0.00 0.00 46.19 44.64 1ui8 s LEU 156 CO 0.02 0.27 0.36 0.00 0.23 0.00 0.00 176.35 177.23 1ui8 s ALA 157 N -0.31 3.76 -0.03 4.21 0.00 -1.26 -0.26 121.76 127.87 1ui8 s ALA 157 Ca 0.01 -0.42 -0.01 0.00 0.00 0.00 0.00 51.96 51.54 1ui8 s ALA 157 Cb -0.13 -2.23 0.02 0.00 0.00 0.00 0.00 23.12 20.79 1ui8 s ALA 157 CO 0.02 0.58 0.06 -0.06 0.00 0.00 0.00 175.76 176.36 1ui8 s PHE 158 N -1.33 -0.04 -0.01 0.00 0.08 -0.05 -1.00 117.98 115.63 1ui8 s PHE 158 Ca 0.30 0.20 -0.21 0.00 0.12 0.00 0.00 56.93 57.34 1ui8 s PHE 158 Cb -0.14 -0.09 -0.05 0.00 -0.57 0.00 0.00 43.02 42.17 1ui8 s PHE 158 CO 0.17 -0.07 0.60 0.08 -0.10 0.00 0.00 175.22 175.90 1ui8 s VAL 159 N 0.61 4.92 -0.30 -0.44 1.01 -0.03 -0.23 120.40 125.94 1ui8 s VAL 159 Ca -0.05 1.26 0.03 0.00 0.00 0.00 0.00 61.98 63.22 1ui8 s VAL 159 Cb -0.07 -3.94 0.08 0.00 0.00 0.00 0.00 36.38 32.45 1ui8 s VAL 159 CO -0.02 0.40 -0.02 -1.58 0.00 0.00 0.00 175.10 173.88 1ui8 s GLN 160 N -0.11 1.97 0.50 2.72 0.74 0.28 -4.22 119.66 121.54 1ui8 s GLN 160 Ca 0.31 -1.56 0.20 0.00 0.05 0.00 0.00 55.36 54.36 1ui8 s GLN 160 Cb -0.18 -3.07 1.28 0.00 1.10 0.00 0.00 33.01 32.13 1ui8 s GLN 160 CO 0.17 -0.74 2.08 -0.44 -0.55 0.00 0.00 175.29 175.81 1ui8 h ASP 161 N 7.75 0.00 -5.03 6.67 3.32 -1.89 -3.44 116.42 123.80 1ui8 h ASP 161 Ca -0.13 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 1ui8 h ASP 161 Cb 1.04 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.48 1ui8 h ASP 161 CO 0.50 0.11 0.14 0.72 -1.72 0.00 0.00 179.24 178.99 1ui8 s PHE 162 N -4.62 -0.36 0.33 4.55 -0.71 -1.26 -5.03 117.98 110.88 1ui8 s PHE 162 Ca -0.04 0.07 0.11 0.00 -1.04 0.00 0.00 56.93 56.03 1ui8 s PHE 162 Cb 0.15 0.51 0.98 0.00 -1.21 0.00 0.00 43.02 43.46 1ui8 s PHE 162 CO 0.64 -0.90 1.66 -1.00 -1.34 0.00 0.00 175.22 174.28 1ui8 h PRO 163 N 2.09 0.30 -0.51 1.99 0.13 -2.02 -0.27 132.00 133.70 1ui8 h PRO 163 Ca -0.31 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1ui8 h PRO 163 Cb 1.28 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1ui8 h PRO 163 CO 0.37 0.20 0.00 0.39 -0.23 0.00 0.00 178.00 178.72 1ui8 n GLU 164 N -5.09 2.26 -2.74 0.86 -0.58 -1.26 -4.95 120.64 109.14 1ui8 n GLU 164 Ca 0.29 -1.95 -0.37 0.00 -0.42 0.00 0.00 57.16 54.71 1ui8 n GLU 164 Cb 0.90 -1.44 -0.06 0.00 -0.57 0.00 0.00 31.44 30.27 1ui8 n GLU 164 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1ui8 s ASP 165 N -1.09 7.23 -0.60 1.62 2.15 -0.11 -5.00 116.67 120.87 1ui8 s ASP 165 Ca 0.37 1.86 -0.24 0.00 0.43 0.00 0.00 52.55 54.97 1ui8 s ASP 165 Cb 0.19 -2.58 0.05 0.00 -0.30 0.00 0.00 42.92 40.29 1ui8 s ASP 165 CO 0.26 -0.15 0.97 -0.55 -0.17 0.00 0.00 175.17 175.53 1ui8 s SER 166 N -1.63 6.28 0.56 -0.34 0.15 -1.26 -4.87 113.70 112.58 1ui8 s SER 166 Ca 0.52 -0.56 0.24 0.00 0.70 0.00 0.00 55.95 56.85 1ui8 s SER 166 Cb -0.19 -2.44 1.57 0.00 -1.71 0.00 0.00 66.02 63.25 1ui8 s SER 166 CO 0.24 -1.33 2.20 0.00 1.20 0.00 0.00 173.24 175.55 1ui8 h ALA 167 N 9.43 1.76 -0.06 5.45 0.00 -1.94 -2.47 119.26 131.44 1ui8 h ALA 167 Ca -0.27 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.66 1ui8 h ALA 167 Cb 1.07 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1ui8 h ALA 167 CO 1.13 -0.02 0.10 -1.49 0.00 0.00 0.00 179.25 178.96 1ui8 h TRP 168 N 0.00 0.00 0.00 0.00 4.06 -1.91 0.14 115.95 118.24 1ui8 h TRP 168 Ca 0.01 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.96 1ui8 h TRP 168 Cb 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.20 1ui8 h TRP 168 CO 0.00 0.00 0.00 0.00 -3.56 0.00 0.00 178.44 174.88 1ui8 h ALA 169 N 1.86 1.00 -2.17 1.49 0.00 -1.76 -3.36 119.26 116.31 1ui8 h ALA 169 Ca 0.03 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.37 1ui8 h ALA 169 Cb 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 17.61 1ui8 h ALA 169 CO -0.00 0.00 -0.78 0.72 0.00 0.00 0.00 179.25 179.18 1ui8 n HIS 170 N -2.36 2.71 -2.15 0.00 8.25 0.48 -4.51 115.22 117.65 1ui8 n HIS 170 Ca 0.03 -3.96 -0.37 0.00 -0.26 0.00 0.00 57.72 53.15 1ui8 n HIS 170 Cb 0.28 -0.48 0.00 0.00 1.12 0.00 0.00 29.99 30.91 1ui8 n HIS 170 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1ui8 s PRO 171 N -2.73 3.59 -0.75 -0.41 0.04 -1.26 -0.85 135.00 132.63 1ui8 s PRO 171 Ca 0.43 1.87 -0.06 0.00 0.04 0.00 0.00 61.00 63.28 1ui8 s PRO 171 Cb 0.24 -2.34 0.19 0.00 0.04 0.00 0.00 34.50 32.63 1ui8 s PRO 171 CO -0.09 -0.72 0.61 0.08 0.04 0.00 0.00 177.00 176.92 1ui8 s VAL 172 N -1.51 4.42 0.85 -0.36 1.01 -0.17 -4.31 120.40 120.34 1ui8 s VAL 172 Ca 0.66 -3.01 -0.11 0.00 0.00 0.00 0.00 61.98 59.51 1ui8 s VAL 172 Cb -0.31 -3.79 0.10 0.00 0.00 0.00 0.00 36.38 32.38 1ui8 s VAL 172 CO 0.37 -0.97 1.09 -0.62 0.00 0.00 0.00 175.10 174.98 1ui8 s ASP 173 N 0.95 3.95 0.00 3.32 -1.08 -1.26 -3.93 116.67 118.62 1ui8 s ASP 173 Ca 0.20 1.42 0.00 0.00 -0.52 0.00 0.00 52.55 53.64 1ui8 s ASP 173 Cb -0.15 -2.12 0.00 0.00 -1.46 0.00 0.00 42.92 39.19 1ui8 s ASP 173 CO -0.06 -2.33 0.00 0.61 0.52 0.00 0.00 175.17 173.91 1ui8 n GLY 174 N -1.56 0.41 2.84 2.66 0.00 -1.26 -4.24 105.19 104.04 1ui8 n GLY 174 Ca 0.07 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.94 1ui8 n GLY 174 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ui8 s LEU 175 N 0.00 1.46 -0.14 0.99 2.96 -1.25 0.25 118.68 122.94 1ui8 s LEU 175 Ca 0.00 -0.02 -0.18 0.00 -0.22 0.00 0.00 54.13 53.71 1ui8 s LEU 175 Cb 0.00 -0.14 0.05 0.00 0.50 0.00 0.00 46.19 46.59 1ui8 s LEU 175 CO 0.00 -0.06 0.48 0.54 -1.32 0.00 0.00 176.35 175.99 1ui8 s VAL 176 N 0.64 0.01 0.09 1.68 0.11 -0.56 -4.61 120.40 117.75 1ui8 s VAL 176 Ca -0.06 -0.08 0.08 0.00 -2.93 0.00 0.00 61.98 58.99 1ui8 s VAL 176 Cb -0.09 -0.71 -0.03 0.00 -1.53 0.00 0.00 36.38 34.02 1ui8 s VAL 176 CO -0.01 -0.04 -0.21 0.00 -3.33 0.00 0.00 175.10 171.50 1ui8 s ALA 177 N -0.17 1.81 -0.09 1.54 0.00 -1.02 -0.17 121.76 123.66 1ui8 s ALA 177 Ca -0.04 -1.20 0.02 0.00 0.00 0.00 0.00 51.96 50.75 1ui8 s ALA 177 Cb -0.03 -0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.79 1ui8 s ALA 177 CO 0.02 0.38 -0.15 0.71 0.00 0.00 0.00 175.76 176.72 1ui8 s TYR 178 N -1.06 2.72 -0.06 0.00 2.02 -0.86 -0.46 117.35 119.64 1ui8 s TYR 178 Ca 0.07 -0.47 0.02 0.00 -0.37 0.00 0.00 57.07 56.32 1ui8 s TYR 178 Cb -0.10 -1.72 0.02 0.00 -0.40 0.00 0.00 41.96 39.76 1ui8 s TYR 178 CO 0.04 -0.06 -0.10 0.08 -1.57 0.00 0.00 175.55 173.94 1ui8 s VAL 179 N -0.15 0.97 -0.61 0.71 1.01 0.32 -0.99 120.40 121.66 1ui8 s VAL 179 Ca -0.01 -0.37 -0.26 0.00 0.00 0.00 0.00 61.98 61.33 1ui8 s VAL 179 Cb -0.14 -0.91 0.04 0.00 0.00 0.00 0.00 36.38 35.37 1ui8 s VAL 179 CO 0.03 0.32 1.11 -0.62 0.00 0.00 0.00 175.10 175.95 1ui8 s ASP 180 N 0.80 6.32 0.00 3.32 -1.08 0.30 -1.09 116.67 125.25 1ui8 s ASP 180 Ca -0.12 -0.26 0.25 0.00 -0.52 0.00 0.00 52.55 51.89 1ui8 s ASP 180 Cb -0.15 -2.51 1.26 0.00 -1.46 0.00 0.00 42.92 40.06 1ui8 s ASP 180 CO 0.02 -1.48 1.83 1.33 0.52 0.00 0.00 175.17 177.39 1ui8 n VAL 181 N 6.39 0.20 -0.10 1.11 0.24 -0.42 -0.30 118.33 125.45 1ui8 n VAL 181 Ca 0.04 0.05 -0.16 0.00 -2.04 0.00 0.00 64.34 62.23 1ui8 n VAL 181 Cb 0.48 -0.64 -0.07 0.00 -1.47 0.00 0.00 33.84 32.14 1ui8 n VAL 181 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1ui8 n VAL 182 N -1.27 1.49 0.67 3.34 0.31 -1.26 -4.25 118.33 117.36 1ui8 n VAL 182 Ca 0.12 0.02 0.12 0.00 -0.01 0.00 0.00 64.34 64.59 1ui8 n VAL 182 Cb 0.19 -2.18 0.47 0.00 -0.91 0.00 0.00 33.84 31.41 1ui8 n VAL 182 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1ui8 n SER 183 N -4.47 0.36 -3.47 4.52 3.41 -1.22 -4.91 113.62 107.84 1ui8 n SER 183 Ca -0.25 0.55 -0.19 0.00 -0.26 0.00 0.00 58.87 58.73 1ui8 n SER 183 Cb 0.55 -0.64 0.09 0.00 -0.26 0.00 0.00 64.21 63.94 1ui8 n SER 183 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ui8 n LYS 184 N -1.86 -6.80 -4.47 4.33 5.02 0.59 -5.03 118.16 109.93 1ui8 n LYS 184 Ca 0.05 0.84 -0.28 0.00 -2.02 0.00 0.00 58.31 56.90 1ui8 n LYS 184 Cb 0.31 -5.84 -0.13 0.00 -0.02 0.00 0.00 35.03 29.34 1ui8 n LYS 184 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1ui8 s GLU 185 N -5.56 1.41 -0.45 1.97 2.02 -0.99 -4.98 118.70 112.12 1ui8 s GLU 185 Ca 0.11 -1.25 -0.19 0.00 0.02 0.00 0.00 54.97 53.66 1ui8 s GLU 185 Cb -0.05 -1.79 0.03 0.00 0.10 0.00 0.00 34.13 32.42 1ui8 s GLU 185 CO 0.73 0.43 0.56 0.08 0.02 0.00 0.00 175.26 177.09 1ui8 s VAL 186 N -1.02 4.93 -0.01 2.63 1.01 -1.26 -0.53 120.40 126.15 1ui8 s VAL 186 Ca 0.12 -0.19 0.11 0.00 0.00 0.00 0.00 61.98 62.02 1ui8 s VAL 186 Cb -0.10 -4.16 -0.06 0.00 0.00 0.00 0.00 36.38 32.05 1ui8 s VAL 186 CO 0.05 -0.58 1.38 0.71 0.00 0.00 0.00 175.10 176.66 1ui8 h THR 187 N 5.82 1.27 -2.86 3.92 1.35 -1.42 -3.48 112.91 117.51 1ui8 h THR 187 Ca -0.26 -2.76 -0.08 0.00 -0.55 0.00 0.00 66.41 62.76 1ui8 h THR 187 Cb 1.10 2.60 -0.17 0.00 -1.73 0.00 0.00 68.15 69.95 1ui8 h THR 187 CO 0.87 0.72 -0.07 -0.13 -0.25 0.00 0.00 175.52 176.66 1ui8 s ARG 188 N -2.87 0.92 -0.39 4.72 1.81 -1.12 -4.96 118.95 117.06 1ui8 s ARG 188 Ca 0.02 -0.24 0.03 0.00 -1.72 0.00 0.00 55.73 53.82 1ui8 s ARG 188 Cb 0.09 0.42 0.16 0.00 -0.45 0.00 0.00 34.95 35.16 1ui8 s ARG 188 CO 0.78 -0.31 0.34 0.08 -0.68 0.00 0.00 175.30 175.51 1ui8 s VAL 189 N -2.15 -0.03 -0.11 3.52 1.01 -1.26 -2.03 120.40 119.35 1ui8 s VAL 189 Ca -0.07 -1.74 -0.24 0.00 0.00 0.00 0.00 61.98 59.93 1ui8 s VAL 189 Cb -0.01 -0.93 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 1ui8 s VAL 189 CO 0.00 -0.87 0.76 -0.63 0.00 0.00 0.00 175.10 174.36 1ui8 s ILE 190 N 0.84 4.97 -0.33 2.22 1.01 0.77 -4.94 121.20 125.74 1ui8 s ILE 190 Ca 0.23 1.53 0.01 0.00 0.00 0.00 0.00 60.65 62.42 1ui8 s ILE 190 Cb -0.11 -4.09 0.10 0.00 0.01 0.00 0.00 42.46 38.38 1ui8 s ILE 190 CO -0.07 0.16 0.10 -0.62 0.00 0.00 0.00 174.94 174.50 1ui8 s ASP 191 N 0.98 4.19 0.00 3.58 -1.08 -1.26 -1.50 116.67 121.58 1ui8 s ASP 191 Ca 0.38 -1.86 0.29 0.00 -0.52 0.00 0.00 52.55 50.84 1ui8 s ASP 191 Cb -0.17 -1.07 1.27 0.00 -1.46 0.00 0.00 42.92 41.48 1ui8 s ASP 191 CO 0.16 -0.39 1.93 0.35 0.52 0.00 0.00 175.17 177.74 1ui8 n THR 192 N 4.58 0.00 0.00 1.71 -2.24 0.14 -4.99 114.28 113.48 1ui8 n THR 192 Ca 0.00 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1ui8 n THR 192 Cb 0.41 -0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.20 1ui8 n THR 192 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ui8 n GLY 193 N 1.44 4.01 3.74 3.38 0.00 -1.22 -5.05 105.19 111.50 1ui8 n GLY 193 Ca 0.09 -1.48 -0.40 0.00 0.00 0.00 0.00 46.02 44.23 1ui8 n GLY 193 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ui8 s VAL 194 N -2.00 4.28 -0.00 1.61 1.01 -1.26 -4.23 120.40 119.80 1ui8 s VAL 194 Ca 0.00 2.02 0.04 0.00 0.00 0.00 0.00 61.98 64.05 1ui8 s VAL 194 Cb 0.00 -4.30 -0.01 0.00 0.00 0.00 0.00 36.38 32.07 1ui8 s VAL 194 CO 0.00 0.43 -0.14 -0.36 0.00 0.00 0.00 175.10 175.04 1ui8 s PHE 195 N -0.72 1.21 0.37 5.22 0.40 -1.26 -5.02 117.98 118.19 1ui8 s PHE 195 Ca 0.42 -0.24 -0.28 0.00 -0.60 0.00 0.00 56.93 56.23 1ui8 s PHE 195 Cb -0.25 -0.77 -0.11 0.00 0.51 0.00 0.00 43.02 42.40 1ui8 s PHE 195 CO 0.30 -0.01 1.50 -2.14 0.70 0.00 0.00 175.22 175.57 1ui8 s PRO 196 N -0.42 4.10 -0.25 0.24 0.02 -1.26 -4.71 135.00 132.72 1ui8 s PRO 196 Ca 0.05 2.58 -0.23 0.00 0.02 0.00 0.00 61.00 63.42 1ui8 s PRO 196 Cb -0.06 -2.97 -0.01 0.00 0.02 0.00 0.00 34.50 31.49 1ui8 s PRO 196 CO -0.00 -0.55 0.75 0.08 -0.33 0.00 0.00 177.00 176.95 1ui8 s VAL 197 N -1.05 4.90 -0.00 3.83 1.01 -1.26 -4.83 120.40 122.99 1ui8 s VAL 197 Ca 0.53 1.39 -0.38 0.00 0.00 0.00 0.00 61.98 63.52 1ui8 s VAL 197 Cb -0.47 -4.04 -0.17 0.00 0.00 0.00 0.00 36.38 31.70 1ui8 s VAL 197 CO 0.63 -0.03 1.35 -2.65 0.00 0.00 0.00 175.10 174.39 1ui8 n PRO 198 N 5.88 0.87 0.05 2.72 -0.02 -1.26 -4.92 135.00 138.32 1ui8 n PRO 198 Ca 0.03 0.31 -0.16 0.00 -2.02 0.00 0.00 63.50 61.66 1ui8 n PRO 198 Cb 0.48 -1.93 -0.14 0.00 -0.02 0.00 0.00 33.50 31.89 1ui8 n PRO 198 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ui8 h ALA 199 N 4.59 0.35 -2.88 3.55 0.00 -1.83 -3.40 119.26 119.64 1ui8 h ALA 199 Ca -0.48 -1.18 -0.53 0.00 0.00 0.00 0.00 54.91 52.72 1ui8 h ALA 199 Cb 1.35 0.35 0.10 0.00 0.00 0.00 0.00 17.79 19.59 1ui8 h ALA 199 CO 0.78 1.21 0.57 -1.21 0.00 0.00 0.00 179.25 180.61 1ui8 s GLU 200 N -2.61 3.55 0.51 0.00 2.02 -1.26 -5.01 118.70 115.90 1ui8 s GLU 200 Ca -0.10 2.08 -0.06 0.00 0.02 0.00 0.00 54.97 56.90 1ui8 s GLU 200 Cb 0.07 -2.43 -0.03 0.00 0.10 0.00 0.00 34.13 31.83 1ui8 s GLU 200 CO 0.84 -0.81 0.84 -3.38 0.02 0.00 0.00 175.26 172.76 1ui8 s HIS 201 N -1.37 3.56 -0.35 1.61 -3.43 -1.26 -4.75 115.29 109.30 1ui8 s HIS 201 Ca 0.65 0.89 0.10 0.00 -0.80 0.00 0.00 55.06 55.90 1ui8 s HIS 201 Cb -0.36 -2.40 0.45 0.00 -1.43 0.00 0.00 32.58 28.84 1ui8 s HIS 201 CO 0.44 -0.38 1.11 0.41 -2.00 0.00 0.00 174.74 174.32 1ui8 n GLY 202 N -2.37 4.91 3.45 -1.38 0.00 -1.26 -5.00 105.19 103.53 1ui8 n GLY 202 Ca 0.02 -2.30 -0.44 0.00 0.00 0.00 0.00 46.02 43.30 1ui8 n GLY 202 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ui8 s ASN 203 N -3.53 6.56 0.00 1.61 0.01 -1.26 -4.77 114.94 113.56 1ui8 s ASN 203 Ca 0.43 -1.90 0.04 0.00 -0.71 0.00 0.00 52.86 50.72 1ui8 s ASN 203 Cb 0.40 -2.40 0.20 0.00 0.41 0.00 0.00 41.25 39.87 1ui8 s ASN 203 CO -0.06 -1.11 0.99 0.00 -1.51 0.00 0.00 177.10 175.40 1ui8 n TYR 204 N 6.67 0.00 0.42 2.20 0.18 -1.26 -1.28 117.16 124.09 1ui8 n TYR 204 Ca 0.20 0.00 0.08 0.00 1.88 0.00 0.00 57.90 60.06 1ui8 n TYR 204 Cb 0.48 -0.32 0.11 0.00 -0.38 0.00 0.00 39.34 39.24 1ui8 n TYR 204 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 1ui8 n THR 205 N -1.32 0.28 -2.80 -3.48 -2.24 -1.26 -4.75 114.28 98.71 1ui8 n THR 205 Ca 0.02 -0.64 -0.42 0.00 -2.27 0.00 0.00 64.05 60.73 1ui8 n THR 205 Cb 0.04 1.11 -0.03 0.00 -2.10 0.00 0.00 70.33 69.34 1ui8 n THR 205 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ui8 s ASP 206 N -1.27 6.87 0.54 3.42 -1.08 -0.41 -4.92 116.67 119.83 1ui8 s ASP 206 Ca 0.23 1.03 0.26 0.00 -0.52 0.00 0.00 52.55 53.56 1ui8 s ASP 206 Cb 0.15 -2.47 1.43 0.00 -1.46 0.00 0.00 42.92 40.56 1ui8 s ASP 206 CO 0.21 -0.65 1.98 -0.65 0.52 0.00 0.00 175.17 176.59 1ui8 h PRO 207 N 7.81 0.00 -0.09 4.34 0.11 -1.88 0.65 132.00 142.94 1ui8 h PRO 207 Ca -0.22 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.84 1ui8 h PRO 207 Cb 1.08 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1ui8 h PRO 207 CO 0.93 0.00 -0.17 1.49 -0.21 0.00 0.00 178.00 180.04 1ui8 h GLU 208 N 0.00 0.15 0.07 1.05 4.22 -1.91 0.13 114.58 118.28 1ui8 h GLU 208 Ca 0.25 -0.03 -0.37 0.00 0.08 0.00 0.00 59.36 59.29 1ui8 h GLU 208 Cb 1.06 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 30.25 1ui8 h GLU 208 CO -0.00 0.32 -2.20 -0.11 -2.18 0.00 0.00 179.01 174.84 1ui8 n LEU 209 N -4.27 2.68 0.07 1.64 7.94 0.20 -4.47 117.00 120.79 1ui8 n LEU 209 Ca -0.01 0.06 -0.12 0.00 -1.11 0.00 0.00 56.01 54.83 1ui8 n LEU 209 Cb 0.28 -0.97 -0.02 0.00 0.53 0.00 0.00 43.42 43.24 1ui8 n LEU 209 CO 0.38 0.87 0.24 0.71 -1.11 0.00 0.00 177.39 178.48 1ui8 h THR 210 N 0.04 1.41 0.00 1.96 1.35 -0.77 -3.50 112.91 113.40 1ui8 h THR 210 Ca -0.49 -2.40 0.00 0.00 -0.55 0.00 0.00 66.41 62.97 1ui8 h THR 210 Cb 1.98 2.35 0.00 0.00 -1.73 0.00 0.00 68.15 70.75 1ui8 h THR 210 CO 0.01 0.71 0.00 0.61 -0.25 0.00 0.00 175.52 176.61 1ui8 n GLY 211 N 0.84 -2.40 3.74 5.82 0.00 0.44 -4.81 105.19 108.82 1ui8 n GLY 211 Ca -0.06 -1.59 -0.42 0.00 0.00 0.00 0.00 46.02 43.96 1ui8 n GLY 211 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1ui8 s PRO 212 N -0.65 4.17 0.43 1.61 0.02 -1.26 -4.83 135.00 134.49 1ui8 s PRO 212 Ca 0.00 2.48 -0.24 0.00 0.02 0.00 0.00 61.00 63.26 1ui8 s PRO 212 Cb 0.00 -3.08 -0.08 0.00 0.02 0.00 0.00 34.50 31.36 1ui8 s PRO 212 CO 0.00 -0.60 1.17 -0.51 -0.33 0.00 0.00 177.00 176.72 1ui8 s LEU 213 N 0.19 4.09 0.47 -5.54 1.43 -1.26 -4.96 118.68 113.09 1ui8 s LEU 213 Ca 0.66 2.32 -0.25 0.00 -1.03 0.00 0.00 54.13 55.83 1ui8 s LEU 213 Cb -0.46 -4.15 -0.08 0.00 0.03 0.00 0.00 46.19 41.54 1ui8 s LEU 213 CO 0.40 -0.80 1.41 0.54 0.23 0.00 0.00 176.35 178.13 1ui8 n ARG 214 N -0.24 2.12 -0.02 1.70 1.74 -1.26 -4.93 116.66 115.77 1ui8 n ARG 214 Ca 0.06 0.76 0.03 0.00 -0.77 0.00 0.00 57.85 57.92 1ui8 n ARG 214 Cb 0.47 -2.60 0.04 0.00 -1.02 0.00 0.00 32.46 29.35 1ui8 n ARG 214 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1ui8 n THR 215 N -0.38 1.23 0.13 0.55 -2.24 -1.26 -4.71 114.28 107.60 1ui8 n THR 215 Ca 0.06 -1.33 0.11 0.00 -2.27 0.00 0.00 64.05 60.62 1ui8 n THR 215 Cb 0.42 0.30 0.04 0.00 -2.10 0.00 0.00 70.33 68.99 1ui8 n THR 215 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1ui8 h THR 216 N 0.06 0.02 -2.96 4.28 1.35 -2.03 -3.46 112.91 110.16 1ui8 h THR 216 Ca 0.00 -1.03 -0.57 0.00 -0.55 0.00 0.00 66.41 64.26 1ui8 h THR 216 Cb 0.64 1.64 -0.05 0.00 -1.73 0.00 0.00 68.15 68.66 1ui8 h THR 216 CO 0.00 0.01 0.88 -1.10 -0.25 0.00 0.00 175.52 175.06 1ui8 s GLN 217 N -3.31 4.22 0.16 4.72 -0.21 -1.26 -5.02 119.66 118.96 1ui8 s GLN 217 Ca 0.01 1.57 -0.04 0.00 0.02 0.00 0.00 55.36 56.92 1ui8 s GLN 217 Cb 0.08 -3.74 -0.05 0.00 1.00 0.00 0.00 33.01 30.30 1ui8 s GLN 217 CO 0.76 -0.71 0.39 0.15 -2.12 0.00 0.00 175.29 173.75 1ui8 s LYS 218 N 3.47 3.59 0.50 2.91 -0.14 -1.26 -5.06 119.74 123.75 1ui8 s LYS 218 Ca 0.52 -0.15 -0.23 0.00 -1.36 0.00 0.00 55.97 54.76 1ui8 s LYS 218 Cb -0.20 -2.84 -0.06 0.00 -1.68 0.00 0.00 37.83 33.05 1ui8 s LYS 218 CO 0.13 0.44 1.27 -1.25 -0.76 0.00 0.00 175.35 175.18 1ui8 s PRO 219 N -2.85 3.48 -0.24 -1.68 0.04 -1.26 -5.02 135.00 127.46 1ui8 s PRO 219 Ca 0.41 2.03 0.01 0.00 0.04 0.00 0.00 61.00 63.48 1ui8 s PRO 219 Cb -0.12 -2.36 0.04 0.00 0.04 0.00 0.00 34.50 32.10 1ui8 s PRO 219 CO 0.26 -0.86 -0.10 0.42 0.04 0.00 0.00 177.00 176.76 1ui8 s ILE 220 N -1.40 2.46 -0.25 0.56 1.01 -1.26 -5.11 121.20 117.21 1ui8 s ILE 220 Ca 0.67 -1.25 -0.10 0.00 0.00 0.00 0.00 60.65 59.96 1ui8 s ILE 220 Cb -0.35 -2.29 -0.05 0.00 0.01 0.00 0.00 42.46 39.78 1ui8 s ILE 220 CO 0.42 0.17 0.16 -0.55 0.00 0.00 0.00 174.94 175.14 1ui8 s SER 221 N 1.23 6.03 -0.26 3.58 0.15 -1.26 -5.07 113.70 118.10 1ui8 s SER 221 Ca -0.02 0.06 -0.00 0.00 0.70 0.00 0.00 55.95 56.68 1ui8 s SER 221 Cb -0.17 -2.10 0.04 0.00 -1.71 0.00 0.00 66.02 62.08 1ui8 s SER 221 CO -0.06 0.03 -0.07 -0.63 1.20 0.00 0.00 173.24 173.71 1ui8 s ILE 222 N 1.29 2.63 0.23 6.45 1.01 -1.26 -5.10 121.20 126.45 1ui8 s ILE 222 Ca 0.07 -1.33 0.04 0.00 0.00 0.00 0.00 60.65 59.43 1ui8 s ILE 222 Cb -0.14 -2.44 -0.05 0.00 0.01 0.00 0.00 42.46 39.83 1ui8 s ILE 222 CO 0.06 0.05 -0.01 0.42 0.00 0.00 0.00 174.94 175.47 1ui8 s THR 223 N 1.23 1.08 -0.37 2.92 -4.23 -1.26 -3.97 115.64 111.04 1ui8 s THR 223 Ca -0.04 -2.04 0.00 0.00 -1.18 0.00 0.00 61.69 58.43 1ui8 s THR 223 Cb -0.18 -2.34 0.13 0.00 1.34 0.00 0.00 72.50 71.44 1ui8 s THR 223 CO -0.04 -0.33 0.19 -1.10 -0.54 0.00 0.00 174.62 172.80 1ui8 s GLN 224 N -3.85 0.82 0.66 3.99 -0.21 -1.26 -4.93 119.66 114.88 1ui8 s GLN 224 Ca 0.28 -1.46 0.32 0.00 0.02 0.00 0.00 55.36 54.52 1ui8 s GLN 224 Cb 0.05 -1.79 1.74 0.00 1.00 0.00 0.00 33.01 34.02 1ui8 s GLN 224 CO 0.09 -1.14 2.00 -1.00 -2.12 0.00 0.00 175.29 173.12 1ui8 h PRO 225 N 7.23 0.00 -0.06 2.91 0.13 -2.03 -1.26 132.00 138.91 1ui8 h PRO 225 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 1ui8 h PRO 225 Cb 0.97 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.10 1ui8 h PRO 225 CO 0.40 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.56 1ui8 n GLU 226 N -3.01 2.53 0.00 0.86 1.02 -1.26 -5.11 120.64 115.67 1ui8 n GLU 226 Ca -0.01 -1.95 0.00 0.00 -0.02 0.00 0.00 57.16 55.18 1ui8 n GLU 226 Cb 0.35 -1.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.55 1ui8 n GLU 226 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ui8 n GLY 227 N -0.61 -0.99 3.76 0.62 0.00 -0.48 -4.97 105.19 102.53 1ui8 n GLY 227 Ca 0.07 -1.65 -0.30 0.00 0.00 0.00 0.00 46.02 44.13 1ui8 n GLY 227 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ui8 s PRO 228 N -1.62 2.00 0.00 1.61 0.04 -1.26 -4.90 135.00 130.86 1ui8 s PRO 228 Ca 0.00 0.94 0.25 0.00 0.04 0.00 0.00 61.00 62.24 1ui8 s PRO 228 Cb 0.00 -1.88 0.56 0.00 0.04 0.00 0.00 34.50 33.22 1ui8 s PRO 228 CO 0.00 -1.76 1.45 0.43 0.04 0.00 0.00 177.00 177.16 1ui8 n SER 229 N -3.57 0.53 -4.93 6.66 7.64 -1.26 -4.89 113.62 113.79 1ui8 n SER 229 Ca 0.08 -0.28 -0.27 0.00 1.01 0.00 0.00 58.87 59.41 1ui8 n SER 229 Cb 0.54 0.21 -0.03 0.00 -1.01 0.00 0.00 64.21 63.92 1ui8 n SER 229 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1ui8 s PHE 230 N -2.95 3.48 -0.00 1.43 -0.12 -1.26 -4.63 117.98 113.93 1ui8 s PHE 230 Ca 0.12 0.32 0.08 0.00 -0.05 0.00 0.00 56.93 57.41 1ui8 s PHE 230 Cb 0.18 -1.84 -0.02 0.00 -0.63 0.00 0.00 43.02 40.71 1ui8 s PHE 230 CO 0.68 0.36 -0.26 0.95 -0.05 0.00 0.00 175.22 176.89 1ui8 s THR 231 N -1.92 2.07 -0.19 -4.49 -4.23 -0.28 -4.97 115.64 101.63 1ui8 s THR 231 Ca 0.38 -1.18 -0.00 0.00 -1.18 0.00 0.00 61.69 59.71 1ui8 s THR 231 Cb -0.11 -1.73 0.01 0.00 1.34 0.00 0.00 72.50 72.01 1ui8 s THR 231 CO 0.30 0.52 -0.16 -0.69 -0.54 0.00 0.00 174.62 174.05 1ui8 s VAL 232 N -0.66 2.45 0.11 2.29 1.01 -1.26 -1.90 120.40 122.44 1ui8 s VAL 232 Ca 0.10 -0.81 0.05 0.00 0.00 0.00 0.00 61.98 61.32 1ui8 s VAL 232 Cb -0.10 -2.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 1ui8 s VAL 232 CO -0.00 0.51 -0.13 0.42 0.00 0.00 0.00 175.10 175.90 1ui8 s THR 233 N 1.27 1.18 -1.77 3.92 -4.23 -0.25 -4.77 115.64 111.00 1ui8 s THR 233 Ca 0.04 -1.64 0.00 0.00 -1.18 0.00 0.00 61.69 58.91 1ui8 s THR 233 Cb -0.14 -1.41 0.00 0.00 1.34 0.00 0.00 72.50 72.29 1ui8 s THR 233 CO -0.09 -0.43 0.00 0.61 -0.54 0.00 0.00 174.62 174.17 1ui8 n GLY 234 N 0.64 -0.20 4.22 3.99 0.00 -1.26 -0.47 105.19 112.10 1ui8 n GLY 234 Ca -0.16 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1ui8 n GLY 234 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ui8 n GLY 235 N -0.96 0.93 0.29 -0.02 0.00 -1.26 -4.33 105.19 99.83 1ui8 n GLY 235 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1ui8 n GLY 235 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ui8 n ASN 236 N 1.86 0.10 -4.64 1.61 6.94 -1.18 -5.01 115.26 114.94 1ui8 n ASN 236 Ca 0.00 -1.64 -0.39 0.00 -0.02 0.00 0.00 54.58 52.53 1ui8 n ASN 236 Cb 0.00 -0.12 -0.08 0.00 -2.36 0.00 0.00 39.78 37.22 1ui8 n ASN 236 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 1ui8 s HIS 237 N -0.10 3.31 -0.11 -2.53 2.46 0.38 -1.24 115.29 117.46 1ui8 s HIS 237 Ca 0.01 0.57 -0.02 0.00 0.47 0.00 0.00 55.06 56.08 1ui8 s HIS 237 Cb 0.01 -2.59 -0.03 0.00 -0.13 0.00 0.00 32.58 29.84 1ui8 s HIS 237 CO 0.00 -0.13 -0.03 0.42 -2.47 0.00 0.00 174.74 172.53 1ui8 s ILE 238 N 1.75 4.03 -0.13 0.89 -1.09 0.76 -1.09 121.20 126.33 1ui8 s ILE 238 Ca 0.18 -0.33 -0.00 0.00 -2.23 0.00 0.00 60.65 58.27 1ui8 s ILE 238 Cb -0.15 -2.72 0.03 0.00 -1.58 0.00 0.00 42.46 38.04 1ui8 s ILE 238 CO 0.09 0.55 -0.09 -1.61 -1.23 0.00 0.00 174.94 172.65 1ui8 s GLU 239 N -0.32 1.76 -0.22 2.79 0.41 -0.80 -1.47 118.70 120.86 1ui8 s GLU 239 Ca 0.06 -0.38 -0.09 0.00 -0.41 0.00 0.00 54.97 54.15 1ui8 s GLU 239 Cb -0.12 -1.80 0.09 0.00 -1.78 0.00 0.00 34.13 30.51 1ui8 s GLU 239 CO 0.02 -0.28 0.48 -0.46 -0.49 0.00 0.00 175.26 174.54 1ui8 s TRP 240 N 1.63 -0.87 -1.12 1.61 -0.00 -0.46 -1.13 118.94 118.59 1ui8 s TRP 240 Ca 0.04 1.67 -0.28 0.00 -0.00 0.00 0.00 56.10 57.53 1ui8 s TRP 240 Cb -0.13 0.41 0.04 0.00 -0.00 0.00 0.00 33.47 33.79 1ui8 s TRP 240 CO -0.09 -0.49 0.53 0.39 -0.00 0.00 0.00 176.95 177.29 1ui8 n GLU 241 N 5.05 -0.36 0.00 5.86 -0.58 -1.26 0.09 120.64 129.43 1ui8 n GLU 241 Ca -0.13 -0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.60 1ui8 n GLU 241 Cb 0.52 -2.18 0.00 0.00 -0.57 0.00 0.00 31.44 29.20 1ui8 n GLU 241 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1ui8 n LYS 242 N -4.59 0.00 -2.66 3.49 4.76 -1.26 -4.93 118.16 112.96 1ui8 n LYS 242 Ca -0.12 0.00 -0.33 0.00 -2.87 0.00 0.00 58.31 54.99 1ui8 n LYS 242 Cb 0.51 -0.76 -0.06 0.00 -1.84 0.00 0.00 35.03 32.89 1ui8 n LYS 242 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1ui8 s TRP 243 N -1.28 3.37 -0.09 2.13 0.52 0.11 -0.07 118.94 123.63 1ui8 s TRP 243 Ca 0.00 1.54 -0.06 0.00 0.02 0.00 0.00 56.10 57.60 1ui8 s TRP 243 Cb 0.00 -2.81 0.03 0.00 -1.15 0.00 0.00 33.47 29.54 1ui8 s TRP 243 CO 0.00 -0.21 0.21 0.45 0.02 0.00 0.00 176.95 177.43 1ui8 s SER 244 N -2.55 -0.22 0.15 2.95 0.15 -0.43 -1.36 113.70 112.40 1ui8 s SER 244 Ca 0.60 0.44 -0.25 0.00 0.70 0.00 0.00 55.95 57.44 1ui8 s SER 244 Cb -0.09 0.37 0.07 0.00 -1.71 0.00 0.00 66.02 64.66 1ui8 s SER 244 CO 0.21 -0.12 0.98 -1.48 1.20 0.00 0.00 173.24 174.02 1ui8 s LEU 245 N 0.78 -0.15 -0.12 3.45 2.34 -0.54 -1.06 118.68 123.38 1ui8 s LEU 245 Ca -0.06 -0.42 0.02 0.00 0.06 0.00 0.00 54.13 53.74 1ui8 s LEU 245 Cb -0.07 2.12 0.01 0.00 -0.56 0.00 0.00 46.19 47.69 1ui8 s LEU 245 CO -0.05 -0.89 -0.20 -1.81 -1.06 0.00 0.00 176.35 172.35 1ui8 s ASP 246 N -2.98 2.83 -0.47 1.48 1.01 -0.11 -0.17 116.67 118.26 1ui8 s ASP 246 Ca 0.13 -0.53 -0.20 0.00 0.71 0.00 0.00 52.55 52.67 1ui8 s ASP 246 Cb -0.01 -1.30 0.04 0.00 1.01 0.00 0.00 42.92 42.66 1ui8 s ASP 246 CO 0.02 0.07 0.63 -0.69 0.21 0.00 0.00 175.17 175.41 1ui8 s VAL 247 N 0.81 4.85 0.46 -1.27 1.01 -0.37 -0.44 120.40 125.45 1ui8 s VAL 247 Ca -0.09 -0.18 0.08 0.00 0.00 0.00 0.00 61.98 61.80 1ui8 s VAL 247 Cb -0.16 -4.24 0.03 0.00 0.00 0.00 0.00 36.38 32.01 1ui8 s VAL 247 CO -0.00 -0.69 0.63 -0.83 0.00 0.00 0.00 175.10 174.21 1ui8 s GLY 248 N 2.30 1.90 -0.14 4.51 0.00 0.11 -4.80 107.32 111.20 1ui8 s GLY 248 Ca 0.19 -1.76 -0.06 0.00 0.00 0.00 0.00 44.72 43.08 1ui8 s GLY 248 CO 0.15 -1.51 0.31 -0.12 0.00 0.00 0.00 173.10 171.93 1ui8 s PHE 249 N -2.44 -0.47 0.02 1.90 5.36 -1.26 -1.51 117.98 119.58 1ui8 s PHE 249 Ca 0.57 1.04 0.08 0.00 -0.96 0.00 0.00 56.93 57.65 1ui8 s PHE 249 Cb -0.09 0.11 -0.02 0.00 -0.34 0.00 0.00 43.02 42.67 1ui8 s PHE 249 CO 0.35 -0.32 -0.23 0.34 -1.46 0.00 0.00 175.22 173.90 1ui8 s ASP 250 N 1.76 2.70 0.46 6.13 2.15 -0.34 -4.91 116.67 124.61 1ui8 s ASP 250 Ca -0.06 -0.49 0.14 0.00 0.43 0.00 0.00 52.55 52.58 1ui8 s ASP 250 Cb -0.11 -0.26 1.04 0.00 -0.30 0.00 0.00 42.92 43.30 1ui8 s ASP 250 CO -0.10 0.23 2.03 1.62 -0.17 0.00 0.00 175.17 178.79 1ui8 h VAL 251 N 4.43 1.10 0.00 1.11 3.04 -1.86 0.29 116.25 124.36 1ui8 h VAL 251 Ca -0.42 -0.43 -0.04 0.00 -1.01 0.00 0.00 66.70 64.79 1ui8 h VAL 251 Cb 1.14 1.17 -0.01 0.00 -2.01 0.00 0.00 31.29 31.59 1ui8 h VAL 251 CO 0.45 0.13 -0.23 -0.09 -1.01 0.00 0.00 177.57 176.83 1ui8 h ARG 252 N 0.06 0.00 0.00 4.17 2.43 -1.89 0.93 114.38 120.08 1ui8 h ARG 252 Ca 0.01 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.15 1ui8 h ARG 252 Cb 0.21 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1ui8 h ARG 252 CO 0.01 0.76 -0.69 0.93 -1.51 0.00 0.00 179.97 179.47 1ui8 h GLU 253 N -1.00 0.00 0.00 0.20 5.08 -1.85 -2.98 114.58 114.03 1ui8 h GLU 253 Ca -0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1ui8 h GLU 253 Cb 0.83 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.08 1ui8 h GLU 253 CO -0.03 0.08 0.00 0.41 -1.00 0.00 0.00 179.01 178.47 1ui8 n GLY 254 N 1.19 0.49 3.73 -3.84 0.00 0.10 -4.59 105.19 102.27 1ui8 n GLY 254 Ca 0.00 -1.15 -0.42 0.00 0.00 0.00 0.00 46.02 44.46 1ui8 n GLY 254 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ui8 s VAL 255 N 0.00 3.16 -0.05 1.61 1.01 -1.26 -1.20 120.40 123.67 1ui8 s VAL 255 Ca 0.00 0.90 0.03 0.00 0.00 0.00 0.00 61.98 62.91 1ui8 s VAL 255 Cb 0.00 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.81 1ui8 s VAL 255 CO 0.00 0.11 -0.14 -0.69 0.00 0.00 0.00 175.10 174.37 1ui8 s VAL 256 N 0.51 1.25 -0.18 2.92 1.01 -0.57 -4.60 120.40 120.74 1ui8 s VAL 256 Ca 0.60 -0.59 -0.08 0.00 0.00 0.00 0.00 61.98 61.91 1ui8 s VAL 256 Cb -0.37 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 1ui8 s VAL 256 CO 0.35 0.37 0.08 -0.76 0.00 0.00 0.00 175.10 175.15 1ui8 s LEU 257 N 0.26 3.95 0.10 3.92 1.43 -0.14 0.07 118.68 128.27 1ui8 s LEU 257 Ca -0.07 0.16 0.10 0.00 -1.03 0.00 0.00 54.13 53.28 1ui8 s LEU 257 Cb -0.12 -2.00 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 1ui8 s LEU 257 CO 0.03 0.21 -0.23 -1.00 0.23 0.00 0.00 176.35 175.58 1ui8 s HIS 258 N 0.18 2.41 -1.33 0.29 3.76 0.42 -0.64 115.29 120.38 1ui8 s HIS 258 Ca 0.06 -0.33 -0.07 0.00 -0.15 0.00 0.00 55.06 54.56 1ui8 s HIS 258 Cb -0.12 -1.33 0.00 0.00 1.11 0.00 0.00 32.58 32.24 1ui8 s HIS 258 CO -0.00 0.30 0.52 0.09 -0.85 0.00 0.00 174.74 174.80 1ui8 n ASN 259 N 1.12 -1.73 -4.67 1.40 3.02 0.41 -0.93 115.26 113.89 1ui8 n ASN 259 Ca -0.17 -1.03 -0.43 0.00 -0.03 0.00 0.00 54.58 52.93 1ui8 n ASN 259 Cb 0.53 -3.04 -0.02 0.00 -0.61 0.00 0.00 39.78 36.64 1ui8 n ASN 259 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1ui8 s ILE 260 N -3.82 3.97 0.08 2.41 1.01 0.56 -4.08 121.20 121.32 1ui8 s ILE 260 Ca 0.15 1.20 -0.01 0.00 0.00 0.00 0.00 60.65 61.99 1ui8 s ILE 260 Cb -0.06 -3.78 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 1ui8 s ILE 260 CO 0.89 -0.09 0.00 0.00 0.00 0.00 0.00 174.94 175.75 1ui8 s ALA 261 N 3.47 0.65 -0.07 9.38 0.00 -0.23 -1.13 121.76 133.83 1ui8 s ALA 261 Ca 0.62 -1.31 0.01 0.00 0.00 0.00 0.00 51.96 51.28 1ui8 s ALA 261 Cb -0.27 0.51 0.02 0.00 0.00 0.00 0.00 23.12 23.38 1ui8 s ALA 261 CO 0.22 -0.42 -0.08 0.12 0.00 0.00 0.00 175.76 175.60 1ui8 s PHE 262 N -3.97 1.23 -0.75 0.00 2.19 0.11 -1.31 117.98 115.48 1ui8 s PHE 262 Ca 0.14 -0.48 -0.25 0.00 0.33 0.00 0.00 56.93 56.67 1ui8 s PHE 262 Cb 0.08 -0.99 0.05 0.00 -1.31 0.00 0.00 43.02 40.85 1ui8 s PHE 262 CO -0.05 -0.32 1.20 0.50 1.83 0.00 0.00 175.22 178.38 1ui8 s ARG 263 N 1.06 3.22 -0.83 10.12 3.52 0.89 -0.94 118.95 136.00 1ui8 s ARG 263 Ca -0.08 -0.56 -0.18 0.00 -0.13 0.00 0.00 55.73 54.79 1ui8 s ARG 263 Cb -0.14 -4.34 0.14 0.00 -1.56 0.00 0.00 34.95 29.05 1ui8 s ARG 263 CO -0.01 -2.05 0.96 0.34 -0.81 0.00 0.00 175.30 173.73 1ui8 s ASP 264 N 3.84 6.55 1.13 -2.12 -1.08 0.34 -4.87 116.67 120.45 1ui8 s ASP 264 Ca 0.32 -2.00 0.00 0.00 -0.52 0.00 0.00 52.55 50.35 1ui8 s ASP 264 Cb -0.10 -2.34 0.00 0.00 -1.46 0.00 0.00 42.92 39.02 1ui8 s ASP 264 CO 0.10 -0.99 0.00 0.61 0.52 0.00 0.00 175.17 175.41 1ui8 n GLY 265 N 5.10 1.02 0.08 2.66 0.00 -1.26 -2.53 105.19 110.26 1ui8 n GLY 265 Ca 0.14 0.36 -0.10 0.00 0.00 0.00 0.00 46.02 46.42 1ui8 n GLY 265 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1ui8 h ASP 266 N 0.00 0.11 -2.96 1.61 2.03 -2.00 -3.48 116.42 111.73 1ui8 h ASP 266 Ca 0.00 -0.14 -0.62 0.00 -0.73 0.00 0.00 57.03 55.54 1ui8 h ASP 266 Cb 0.00 -0.04 -0.12 0.00 -0.83 0.00 0.00 39.33 38.34 1ui8 h ASP 266 CO 0.00 1.12 -0.69 0.00 -1.03 0.00 0.00 179.24 178.64 1ui8 s ARG 267 N -2.66 2.27 -0.44 4.15 1.70 -1.05 -5.08 118.95 117.84 1ui8 s ARG 267 Ca -0.03 -1.16 -0.19 0.00 -0.47 0.00 0.00 55.73 53.89 1ui8 s ARG 267 Cb 0.09 -2.29 0.03 0.00 -0.57 0.00 0.00 34.95 32.21 1ui8 s ARG 267 CO 0.83 0.45 0.53 -1.17 -1.08 0.00 0.00 175.30 174.86 1ui8 s LEU 268 N -2.86 4.76 -0.31 -1.89 2.96 -1.26 -0.51 118.68 119.58 1ui8 s LEU 268 Ca 0.26 -0.59 -0.12 0.00 -0.22 0.00 0.00 54.13 53.46 1ui8 s LEU 268 Cb -0.09 -2.51 -0.04 0.00 0.50 0.00 0.00 46.19 44.05 1ui8 s LEU 268 CO 0.17 -0.68 0.21 -0.13 -1.32 0.00 0.00 176.35 174.60 1ui8 s ARG 269 N 2.42 3.76 0.53 1.98 0.52 -0.11 -4.90 118.95 123.15 1ui8 s ARG 269 Ca 0.16 -0.45 -0.20 0.00 -0.52 0.00 0.00 55.73 54.72 1ui8 s ARG 269 Cb -0.16 -3.72 -0.06 0.00 0.52 0.00 0.00 34.95 31.53 1ui8 s ARG 269 CO 0.15 -0.29 1.13 -1.25 0.02 0.00 0.00 175.30 175.06 1ui8 s PRO 270 N 1.75 3.40 0.11 3.54 0.04 -1.26 -0.71 135.00 141.85 1ui8 s PRO 270 Ca 0.07 1.63 0.00 0.00 0.04 0.00 0.00 61.00 62.73 1ui8 s PRO 270 Cb -0.17 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.33 1ui8 s PRO 270 CO 0.11 -0.82 0.00 -0.89 0.04 0.00 0.00 177.00 175.44 1ui8 n ILE 271 N -1.22 0.68 -4.17 0.56 5.41 -0.28 -0.10 119.36 120.23 1ui8 n ILE 271 Ca 0.11 0.22 -0.23 0.00 1.00 0.00 0.00 62.75 63.85 1ui8 n ILE 271 Cb 0.51 -1.31 -0.17 0.00 -0.71 0.00 0.00 39.64 37.96 1ui8 n ILE 271 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1ui8 s ILE 272 N -2.00 0.81 0.11 1.39 1.01 -1.01 -1.22 121.20 120.29 1ui8 s ILE 272 Ca 0.00 -0.23 -0.13 0.00 0.00 0.00 0.00 60.65 60.28 1ui8 s ILE 272 Cb 0.00 -0.82 -0.11 0.00 0.01 0.00 0.00 42.46 41.54 1ui8 s ILE 272 CO 0.00 0.30 1.37 -1.13 0.00 0.00 0.00 174.94 175.48 1ui8 h ASN 273 N 7.51 0.90 -3.31 3.58 -0.00 -0.42 0.16 115.58 124.00 1ui8 h ASN 273 Ca -0.31 -0.55 -0.07 0.00 -0.00 0.00 0.00 56.30 55.37 1ui8 h ASN 273 Cb 1.15 -0.26 -0.24 0.00 -0.00 0.00 0.00 38.32 38.97 1ui8 h ASN 273 CO 0.43 1.29 -0.15 -0.60 -0.00 0.00 0.00 177.43 178.41 1ui8 s ARG 274 N -4.04 0.55 -0.06 6.67 3.52 -1.07 -0.44 118.95 124.08 1ui8 s ARG 274 Ca -0.11 0.92 0.03 0.00 -0.13 0.00 0.00 55.73 56.44 1ui8 s ARG 274 Cb 0.09 0.10 0.01 0.00 -1.56 0.00 0.00 34.95 33.59 1ui8 s ARG 274 CO 0.88 -0.14 -0.15 0.00 -0.81 0.00 0.00 175.30 175.09 1ui8 s ALA 275 N 1.22 1.38 0.19 6.12 0.00 0.18 -0.74 121.76 130.12 1ui8 s ALA 275 Ca -0.08 -0.54 -0.22 0.00 0.00 0.00 0.00 51.96 51.12 1ui8 s ALA 275 Cb -0.06 -0.54 0.05 0.00 0.00 0.00 0.00 23.12 22.57 1ui8 s ALA 275 CO -0.12 0.19 0.61 -1.54 0.00 0.00 0.00 175.76 174.90 1ui8 s SER 276 N 0.37 -0.47 -0.75 0.00 1.04 -0.93 -0.96 113.70 112.00 1ui8 s SER 276 Ca -0.10 -0.18 -0.19 0.00 0.48 0.00 0.00 55.95 55.97 1ui8 s SER 276 Cb -0.14 0.62 0.12 0.00 0.10 0.00 0.00 66.02 66.73 1ui8 s SER 276 CO 0.03 -1.05 0.90 -0.63 0.98 0.00 0.00 173.24 173.47 1ui8 s ILE 277 N -3.80 4.82 -1.32 -1.02 -1.09 -1.26 -0.61 121.20 116.91 1ui8 s ILE 277 Ca 0.04 -1.29 0.27 0.00 -2.23 0.00 0.00 60.65 57.44 1ui8 s ILE 277 Cb -0.02 -4.62 0.42 0.00 -1.58 0.00 0.00 42.46 36.66 1ui8 s ILE 277 CO -0.08 -1.30 1.93 0.00 -1.23 0.00 0.00 174.94 174.26 1ui8 n ALA 278 N 6.30 2.34 -3.56 9.38 0.00 0.57 -4.77 120.51 130.77 1ui8 n ALA 278 Ca 0.06 -0.12 -0.07 0.00 0.00 0.00 0.00 53.44 53.31 1ui8 n ALA 278 Cb 0.46 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.44 1ui8 n ALA 278 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1ui8 s GLU 279 N -2.68 0.56 -0.28 0.00 2.56 -1.23 -4.47 118.70 113.16 1ui8 s GLU 279 Ca 0.23 -0.14 -0.08 0.00 0.00 0.00 0.00 54.97 54.98 1ui8 s GLU 279 Cb 0.18 0.26 0.13 0.00 2.00 0.00 0.00 34.13 36.70 1ui8 s GLU 279 CO 0.44 -0.23 0.59 1.41 -0.56 0.00 0.00 175.26 176.91 1ui8 s MET 280 N -2.42 0.52 0.05 4.30 -2.45 -1.26 -1.33 119.30 116.71 1ui8 s MET 280 Ca 0.06 1.28 0.08 0.00 -1.25 0.00 0.00 55.69 55.86 1ui8 s MET 280 Cb -0.01 0.68 -0.03 0.00 1.25 0.00 0.00 34.83 36.72 1ui8 s MET 280 CO -0.06 -0.29 -0.23 0.54 1.05 0.00 0.00 175.02 176.03 1ui8 s VAL 281 N 2.83 2.42 -0.56 10.11 0.11 0.47 -1.59 120.40 134.20 1ui8 s VAL 281 Ca -0.00 -1.31 0.04 0.00 -2.93 0.00 0.00 61.98 57.77 1ui8 s VAL 281 Cb -0.13 -1.98 0.15 0.00 -1.53 0.00 0.00 36.38 32.89 1ui8 s VAL 281 CO -0.18 0.35 0.34 -0.69 -3.33 0.00 0.00 175.10 171.59 1ui8 s VAL 282 N -0.86 2.20 0.16 2.04 1.01 0.11 -0.83 120.40 124.22 1ui8 s VAL 282 Ca 0.13 -3.42 -0.28 0.00 0.00 0.00 0.00 61.98 58.42 1ui8 s VAL 282 Cb -0.10 -2.50 -0.07 0.00 0.00 0.00 0.00 36.38 33.71 1ui8 s VAL 282 CO 0.03 -0.94 0.86 -2.16 0.00 0.00 0.00 175.10 172.90 1ui8 s PRO 283 N -0.52 4.67 -0.10 2.72 0.04 -1.19 -1.85 135.00 138.77 1ui8 s PRO 283 Ca 0.21 1.30 -0.05 0.00 0.04 0.00 0.00 61.00 62.50 1ui8 s PRO 283 Cb -0.15 -3.31 -0.04 0.00 0.04 0.00 0.00 34.50 31.04 1ui8 s PRO 283 CO -0.08 0.44 0.10 0.71 0.04 0.00 0.00 177.00 178.21 1ui8 s TYR 284 N -0.77 3.45 -0.34 0.56 1.51 -0.92 -1.49 117.35 119.35 1ui8 s TYR 284 Ca 0.40 0.41 0.08 0.00 -1.01 0.00 0.00 57.07 56.95 1ui8 s TYR 284 Cb -0.24 -1.88 0.62 0.00 -0.11 0.00 0.00 41.96 40.35 1ui8 s TYR 284 CO 0.28 0.64 1.69 0.41 -1.11 0.00 0.00 175.55 177.47 1ui8 n GLY 285 N 1.97 4.40 3.57 0.71 0.00 0.11 -4.91 105.19 111.05 1ui8 n GLY 285 Ca -0.19 -1.11 -0.40 0.00 0.00 0.00 0.00 46.02 44.32 1ui8 n GLY 285 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ui8 s ASP 286 N -1.73 6.21 0.00 1.61 2.15 -1.26 -4.82 116.67 118.83 1ui8 s ASP 286 Ca 0.51 0.02 0.21 0.00 0.43 0.00 0.00 52.55 53.72 1ui8 s ASP 286 Cb 0.43 -2.20 1.25 0.00 -0.30 0.00 0.00 42.92 42.10 1ui8 s ASP 286 CO 0.07 -0.27 1.65 -0.81 -0.17 0.00 0.00 175.17 175.64 1ui8 n PRO 287 N 5.37 0.64 -1.87 4.34 -0.04 -1.26 -3.39 135.00 138.79 1ui8 n PRO 287 Ca -0.09 0.01 -0.41 0.00 -0.04 0.00 0.00 63.50 62.97 1ui8 n PRO 287 Cb 0.50 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.44 1ui8 n PRO 287 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1ui8 s SER 288 N -2.04 6.47 0.62 3.54 0.15 -1.26 -4.68 113.70 116.50 1ui8 s SER 288 Ca 0.31 2.87 0.41 0.00 0.70 0.00 0.00 55.95 60.24 1ui8 s SER 288 Cb 0.15 -2.64 2.17 0.00 -1.71 0.00 0.00 66.02 63.99 1ui8 s SER 288 CO 0.25 -0.83 2.26 1.55 1.20 0.00 0.00 173.24 177.67 1ui8 h PRO 289 N 4.53 0.00 0.00 5.44 0.13 -1.98 0.43 132.00 140.55 1ui8 h PRO 289 Ca -0.47 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 1ui8 h PRO 289 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.35 1ui8 h PRO 289 CO 0.76 0.00 -0.24 0.82 -0.23 0.00 0.00 178.00 179.10 1ui8 h ILE 290 N 0.00 0.86 0.00 -3.56 1.08 -1.94 -3.36 117.51 110.59 1ui8 h ILE 290 Ca 0.00 -0.95 0.00 0.00 -0.39 0.00 0.00 64.86 63.52 1ui8 h ILE 290 Cb 0.08 1.56 0.00 0.00 -3.07 0.00 0.00 36.82 35.39 1ui8 h ILE 290 CO 0.00 0.24 0.00 0.54 -0.69 0.00 0.00 178.15 178.24 1ui8 n ARG 291 N -3.80 0.30 0.00 2.37 1.74 -0.07 -4.86 116.66 112.35 1ui8 n ARG 291 Ca -0.01 -0.08 0.02 0.00 -0.77 0.00 0.00 57.85 57.00 1ui8 n ARG 291 Cb 0.34 -0.47 0.10 0.00 -1.02 0.00 0.00 32.46 31.41 1ui8 n ARG 291 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1ui8 n SER 292 N -0.07 0.00 -0.12 0.55 3.41 0.13 -1.12 113.62 116.40 1ui8 n SER 292 Ca 0.00 0.41 0.11 0.00 -0.26 0.00 0.00 58.87 59.13 1ui8 n SER 292 Cb 0.14 -0.43 -0.04 0.00 -0.26 0.00 0.00 64.21 63.61 1ui8 n SER 292 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 1ui8 n TRP 293 N -1.43 0.00 -2.16 7.33 4.27 -1.26 -4.97 117.44 119.21 1ui8 n TRP 293 Ca 0.01 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.20 1ui8 n TRP 293 Cb 0.05 -0.03 -0.02 0.00 -1.36 0.00 0.00 31.31 29.95 1ui8 n TRP 293 CO 0.00 0.00 0.00 -1.14 -2.29 0.00 0.00 177.69 174.26 1ui8 s GLN 294 N -2.86 3.79 -0.27 -2.67 0.74 -0.28 -4.72 119.66 113.39 1ui8 s GLN 294 Ca 0.11 1.57 0.00 0.00 0.05 0.00 0.00 55.36 57.09 1ui8 s GLN 294 Cb 0.17 -4.02 0.16 0.00 1.10 0.00 0.00 33.01 30.42 1ui8 s GLN 294 CO 0.77 -1.29 0.45 -0.80 -0.55 0.00 0.00 175.29 173.87 1ui8 s ASN 295 N 4.06 -0.21 -0.14 6.67 0.01 -1.26 -2.17 114.94 121.90 1ui8 s ASN 295 Ca 0.69 0.15 -0.19 0.00 -0.71 0.00 0.00 52.86 52.80 1ui8 s ASN 295 Cb -0.23 1.40 -0.04 0.00 0.41 0.00 0.00 41.25 42.79 1ui8 s ASN 295 CO 0.28 -0.31 0.51 -0.31 -1.51 0.00 0.00 177.10 175.76 1ui8 s TYR 296 N 2.63 3.47 -0.87 2.20 2.02 -0.77 -4.85 117.35 121.18 1ui8 s TYR 296 Ca 0.13 0.88 -0.07 0.00 -0.37 0.00 0.00 57.07 57.64 1ui8 s TYR 296 Cb -0.14 -2.61 0.22 0.00 -0.40 0.00 0.00 41.96 39.03 1ui8 s TYR 296 CO -0.22 0.07 0.78 -0.06 -1.57 0.00 0.00 175.55 174.55 1ui8 s PHE 297 N 0.99 3.84 0.26 2.71 0.40 -1.26 0.04 117.98 124.96 1ui8 s PHE 297 Ca 0.26 -2.59 -0.02 0.00 -0.60 0.00 0.00 56.93 53.98 1ui8 s PHE 297 Cb -0.15 -3.54 0.53 0.00 0.51 0.00 0.00 43.02 40.36 1ui8 s PHE 297 CO 0.11 -0.88 1.72 -0.44 0.70 0.00 0.00 175.22 176.43 1ui8 h ASP 298 N 6.88 0.30 0.06 1.36 3.32 -1.68 0.10 116.42 126.78 1ui8 h ASP 298 Ca 0.11 0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.28 1ui8 h ASP 298 Cb 0.92 0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.57 1ui8 h ASP 298 CO 0.83 0.09 -0.03 0.74 -1.72 0.00 0.00 179.24 179.15 1ui8 h THR 299 N 0.45 0.92 -0.29 0.35 2.02 -1.85 -0.62 112.91 113.89 1ui8 h THR 299 Ca 0.45 -1.51 -0.12 0.00 0.77 0.00 0.00 66.41 66.00 1ui8 h THR 299 Cb 0.73 1.68 -0.00 0.00 -1.74 0.00 0.00 68.15 68.82 1ui8 h THR 299 CO -0.43 0.29 -0.29 1.23 0.37 0.00 0.00 175.52 176.68 1ui8 h GLY 300 N -0.95 0.78 0.58 2.16 0.00 -1.83 -2.35 103.07 101.47 1ui8 h GLY 300 Ca -0.01 -0.80 -0.37 0.00 0.00 0.00 0.00 47.33 46.16 1ui8 h GLY 300 CO 0.01 0.72 -2.02 1.18 0.00 0.00 0.00 176.54 176.43 1ui8 n GLU 301 N -4.25 0.75 -0.05 4.80 1.02 0.34 -4.50 120.64 118.75 1ui8 n GLU 301 Ca -0.04 0.26 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 1ui8 n GLU 301 Cb 0.48 -1.70 -0.16 0.00 -0.02 0.00 0.00 31.44 30.03 1ui8 n GLU 301 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1ui8 n TYR 302 N -3.46 0.02 -1.97 -0.32 4.02 -1.10 -1.78 117.16 112.57 1ui8 n TYR 302 Ca -0.33 0.01 -0.01 0.00 -0.01 0.00 0.00 57.90 57.57 1ui8 n TYR 302 Cb 1.04 -0.76 0.00 0.00 -0.02 0.00 0.00 39.34 39.60 1ui8 n TYR 302 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1ui8 n LEU 303 N -2.52 -4.28 -0.17 7.72 4.32 -0.25 -4.88 117.00 116.94 1ui8 n LEU 303 Ca -0.19 0.49 0.04 0.00 -0.02 0.00 0.00 56.01 56.33 1ui8 n LEU 303 Cb 0.87 -1.89 0.33 0.00 -1.62 0.00 0.00 43.42 41.10 1ui8 n LEU 303 CO 0.44 -1.17 1.22 -0.37 -1.22 0.00 0.00 177.39 176.30 1ui8 h VAL 304 N 1.09 1.08 -0.19 4.08 -1.51 -1.36 -2.76 116.25 116.67 1ui8 h VAL 304 Ca 0.00 -0.28 -0.03 0.00 -1.23 0.00 0.00 66.70 65.16 1ui8 h VAL 304 Cb 0.06 0.19 -0.01 0.00 -2.13 0.00 0.00 31.29 29.40 1ui8 h VAL 304 CO 0.04 0.15 0.00 1.23 -1.23 0.00 0.00 177.57 177.76 1ui8 h GLY 305 N 0.82 0.29 2.00 5.19 0.00 -0.91 -2.56 103.07 107.89 1ui8 h GLY 305 Ca 0.29 -0.14 -0.02 0.00 0.00 0.00 0.00 47.33 47.45 1ui8 h GLY 305 CO -0.08 0.14 -0.08 0.06 0.00 0.00 0.00 176.54 176.57 1ui8 h GLN 306 N 0.27 0.00 -0.67 4.80 3.07 -1.16 -2.64 115.11 118.78 1ui8 h GLN 306 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.80 1ui8 h GLN 306 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.75 1ui8 h GLN 306 CO 0.00 0.08 0.00 0.66 0.09 0.00 0.00 178.83 179.66 1ui8 n TYR 307 N -3.28 1.37 -1.71 0.06 4.01 -0.97 -4.98 117.16 111.66 1ui8 n TYR 307 Ca -0.00 -0.56 -0.43 0.00 -0.16 0.00 0.00 57.90 56.74 1ui8 n TYR 307 Cb 0.29 -0.19 -0.02 0.00 -0.31 0.00 0.00 39.34 39.11 1ui8 n TYR 307 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ui8 n ALA 308 N 1.22 2.03 -1.82 -0.72 0.00 -1.00 -2.73 120.51 117.49 1ui8 n ALA 308 Ca 0.25 0.40 -0.32 0.00 0.00 0.00 0.00 53.44 53.77 1ui8 n ALA 308 Cb 0.82 -2.40 -0.01 0.00 0.00 0.00 0.00 19.45 17.86 1ui8 n ALA 308 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1ui8 s ASN 309 N 0.57 6.32 -0.44 0.00 0.02 0.12 -4.96 114.94 116.57 1ui8 s ASN 309 Ca 0.68 1.53 -0.23 0.00 -1.02 0.00 0.00 52.86 53.82 1ui8 s ASN 309 Cb -0.56 -2.49 0.02 0.00 0.02 0.00 0.00 41.25 38.24 1ui8 s ASN 309 CO 0.45 -0.80 0.77 -0.44 0.02 0.00 0.00 177.10 177.10 1ui8 s SER 310 N -3.55 6.41 0.28 -1.22 0.01 -1.26 -4.29 113.70 110.09 1ui8 s SER 310 Ca 0.58 -0.10 -0.29 0.00 1.31 0.00 0.00 55.95 57.44 1ui8 s SER 310 Cb -0.11 -2.38 -0.10 0.00 0.21 0.00 0.00 66.02 63.65 1ui8 s SER 310 CO 0.43 -0.89 1.15 -0.76 0.41 0.00 0.00 173.24 173.58 1ui8 s LEU 311 N 3.22 4.52 -0.13 2.44 2.01 0.76 -4.98 118.68 126.52 1ui8 s LEU 311 Ca 0.29 2.36 -0.06 0.00 0.01 0.00 0.00 54.13 56.73 1ui8 s LEU 311 Cb -0.12 -3.63 -0.04 0.00 0.01 0.00 0.00 46.19 42.41 1ui8 s LEU 311 CO 0.22 -0.24 0.07 -1.61 1.01 0.00 0.00 176.35 175.79 1ui8 s GLU 312 N -1.42 3.52 0.20 1.70 0.41 -1.26 -4.83 118.70 117.01 1ui8 s GLU 312 Ca 0.46 -0.29 -0.30 0.00 -0.41 0.00 0.00 54.97 54.42 1ui8 s GLU 312 Cb -0.34 -3.09 -0.09 0.00 -1.78 0.00 0.00 34.13 28.84 1ui8 s GLU 312 CO 0.43 0.56 1.41 -1.17 -0.49 0.00 0.00 175.26 176.00 1ui8 s LEU 313 N -0.44 4.39 0.00 1.80 2.96 -1.26 -0.99 118.68 125.14 1ui8 s LEU 313 Ca 0.10 2.51 0.00 0.00 -0.22 0.00 0.00 54.13 56.52 1ui8 s LEU 313 Cb -0.12 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 42.96 1ui8 s LEU 313 CO 0.02 -0.66 0.00 0.61 -1.32 0.00 0.00 176.35 175.00 1ui8 n GLY 314 N 2.71 2.33 0.08 7.98 0.00 0.11 -4.72 105.19 113.68 1ui8 n GLY 314 Ca 0.08 -0.26 -0.08 0.00 0.00 0.00 0.00 46.02 45.76 1ui8 n GLY 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ui8 h ASP 316 N -1.00 0.52 -3.29 0.00 3.32 -1.35 -3.45 116.42 111.16 1ui8 h ASP 316 Ca -0.06 -0.95 -0.52 0.00 0.02 0.00 0.00 57.03 55.52 1ui8 h ASP 316 Cb 0.72 -0.17 -0.38 0.00 0.22 0.00 0.00 39.33 39.72 1ui8 h ASP 316 CO -0.04 1.83 -0.78 0.00 -1.72 0.00 0.00 179.24 178.53 1ui8 s LEU 318 N 1.76 3.86 0.00 0.00 2.96 -1.26 -0.71 118.68 125.29 1ui8 s LEU 318 Ca 0.01 0.18 0.00 0.00 -0.22 0.00 0.00 54.13 54.10 1ui8 s LEU 318 Cb -0.15 -2.11 0.00 0.00 0.50 0.00 0.00 46.19 44.43 1ui8 s LEU 318 CO -0.07 0.32 0.00 0.61 -1.32 0.00 0.00 176.35 175.89 1ui8 n GLY 319 N 1.56 -0.25 3.40 7.98 0.00 -1.25 -4.84 105.19 111.79 1ui8 n GLY 319 Ca -0.16 -1.99 -0.44 0.00 0.00 0.00 0.00 46.02 43.44 1ui8 n GLY 319 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ui8 s ASP 320 N -4.00 6.19 -0.12 1.61 -1.08 -1.26 -4.93 116.67 113.08 1ui8 s ASP 320 Ca 0.00 -1.28 -0.05 0.00 -0.52 0.00 0.00 52.55 50.70 1ui8 s ASP 320 Cb 0.00 -2.35 -0.04 0.00 -1.46 0.00 0.00 42.92 39.07 1ui8 s ASP 320 CO 0.00 -1.24 0.08 -0.63 0.52 0.00 0.00 175.17 173.90 1ui8 s ILE 321 N 3.21 5.00 -0.20 4.11 -1.09 -1.26 -4.63 121.20 126.35 1ui8 s ILE 321 Ca 0.16 0.02 -0.01 0.00 -2.23 0.00 0.00 60.65 58.59 1ui8 s ILE 321 Cb -0.21 -3.17 0.01 0.00 -1.58 0.00 0.00 42.46 37.51 1ui8 s ILE 321 CO 0.07 0.59 -0.13 -0.89 -1.23 0.00 0.00 174.94 173.36 1ui8 s THR 322 N -0.78 2.65 0.26 2.92 2.01 0.20 -4.96 115.64 117.94 1ui8 s THR 322 Ca 0.13 -0.74 -0.03 0.00 0.31 0.00 0.00 61.69 61.36 1ui8 s THR 322 Cb -0.12 -2.16 -0.05 0.00 0.01 0.00 0.00 72.50 70.18 1ui8 s THR 322 CO 0.03 0.49 0.49 -0.31 -0.69 0.00 0.00 174.62 174.63 1ui8 s TYR 323 N 1.34 3.48 -0.14 4.92 2.02 -1.26 -0.76 117.35 126.95 1ui8 s TYR 323 Ca 0.05 0.52 0.00 0.00 -0.37 0.00 0.00 57.07 57.27 1ui8 s TYR 323 Cb -0.14 -2.00 0.02 0.00 -0.40 0.00 0.00 41.96 39.44 1ui8 s TYR 323 CO -0.08 0.25 -0.13 -0.51 -1.57 0.00 0.00 175.55 173.50 1ui8 s LEU 324 N -3.49 1.61 -0.98 -1.29 1.43 -0.29 -4.98 118.68 110.69 1ui8 s LEU 324 Ca 0.42 -0.46 -0.11 0.00 -1.03 0.00 0.00 54.13 52.95 1ui8 s LEU 324 Cb -0.11 -1.13 0.25 0.00 0.03 0.00 0.00 46.19 45.24 1ui8 s LEU 324 CO 0.30 -0.06 0.94 -0.44 0.23 0.00 0.00 176.35 177.32 1ui8 s SER 325 N 1.50 7.00 0.66 2.29 0.01 -1.26 -1.64 113.70 122.26 1ui8 s SER 325 Ca 0.05 -3.22 -0.17 0.00 1.31 0.00 0.00 55.95 53.92 1ui8 s SER 325 Cb -0.13 -2.19 0.00 0.00 0.21 0.00 0.00 66.02 63.91 1ui8 s SER 325 CO -0.10 -0.40 1.21 -2.16 0.41 0.00 0.00 173.24 172.19 1ui8 s PRO 326 N -0.66 2.55 -0.10 12.44 0.04 -1.23 -4.60 135.00 143.43 1ui8 s PRO 326 Ca 0.25 1.78 0.00 0.00 0.04 0.00 0.00 61.00 63.07 1ui8 s PRO 326 Cb -0.10 -1.88 -0.02 0.00 0.04 0.00 0.00 34.50 32.53 1ui8 s PRO 326 CO -0.08 -1.52 -0.10 0.08 0.04 0.00 0.00 177.00 175.41 1ui8 s VAL 327 N -1.82 3.36 0.40 -0.36 1.01 -1.26 -0.41 120.40 121.32 1ui8 s VAL 327 Ca 0.76 -0.58 0.04 0.00 0.00 0.00 0.00 61.98 62.20 1ui8 s VAL 327 Cb -0.30 -2.40 -0.05 0.00 0.00 0.00 0.00 36.38 33.64 1ui8 s VAL 327 CO 0.40 0.55 0.06 0.27 0.00 0.00 0.00 175.10 176.38 1ui8 s ILE 328 N -0.16 1.13 -0.00 2.22 -4.36 0.12 -4.86 121.20 115.28 1ui8 s ILE 328 Ca 0.01 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 58.38 1ui8 s ILE 328 Cb -0.13 -2.58 -0.04 0.00 1.25 0.00 0.00 42.46 40.96 1ui8 s ILE 328 CO 0.03 0.00 0.17 -0.55 0.24 0.00 0.00 174.94 174.83 1ui8 s SER 329 N -3.63 6.26 0.77 4.36 0.15 -1.26 0.77 113.70 121.12 1ui8 s SER 329 Ca 0.27 0.31 -0.02 0.00 0.70 0.00 0.00 55.95 57.21 1ui8 s SER 329 Cb 0.06 -1.94 0.05 0.00 -1.71 0.00 0.00 66.02 62.47 1ui8 s SER 329 CO 0.13 0.26 0.30 -0.90 1.20 0.00 0.00 173.24 174.23 1ui8 n ASP 330 N 0.93 0.17 0.04 5.45 3.85 0.82 -4.86 116.55 122.95 1ui8 n ASP 330 Ca -0.11 -1.20 0.07 0.00 -0.71 0.00 0.00 54.79 52.85 1ui8 n ASP 330 Cb 0.52 -0.22 0.31 0.00 -1.35 0.00 0.00 41.12 40.39 1ui8 n ASP 330 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1ui8 n ALA 331 N -3.11 1.47 0.12 2.12 0.00 -1.26 -2.40 120.51 117.45 1ui8 n ALA 331 Ca -0.05 0.01 0.05 0.00 0.00 0.00 0.00 53.44 53.46 1ui8 n ALA 331 Cb 0.15 -1.23 0.10 0.00 0.00 0.00 0.00 19.45 18.47 1ui8 n ALA 331 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1ui8 n PHE 332 N -1.73 0.24 -0.35 0.00 3.72 -1.26 -0.11 117.46 117.97 1ui8 n PHE 332 Ca 0.02 -0.27 0.00 0.00 -0.05 0.00 0.00 57.45 57.15 1ui8 n PHE 332 Cb 0.13 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 1ui8 n PHE 332 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ui8 n GLY 333 N 0.55 0.74 3.78 1.37 0.00 -1.01 -4.98 105.19 105.64 1ui8 n GLY 333 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 1ui8 n GLY 333 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ui8 s ASN 334 N -2.60 7.22 0.34 1.61 -0.87 -1.26 -4.38 114.94 115.00 1ui8 s ASN 334 Ca 0.00 1.45 -0.27 0.00 -1.57 0.00 0.00 52.86 52.47 1ui8 s ASN 334 Cb 0.00 -2.44 -0.09 0.00 -0.02 0.00 0.00 41.25 38.70 1ui8 s ASN 334 CO 0.00 0.18 1.11 -2.16 -2.57 0.00 0.00 177.10 173.65 1ui8 s PRO 335 N -0.81 4.39 -0.07 -0.60 0.04 -1.26 -0.12 135.00 136.56 1ui8 s PRO 335 Ca 0.34 1.75 0.01 0.00 0.04 0.00 0.00 61.00 63.14 1ui8 s PRO 335 Cb -0.21 -2.92 0.02 0.00 0.04 0.00 0.00 34.50 31.43 1ui8 s PRO 335 CO 0.23 0.00 -0.07 0.50 0.04 0.00 0.00 177.00 177.70 1ui8 s ARG 336 N -1.90 1.19 -0.04 4.56 3.52 0.23 -4.86 118.95 121.66 1ui8 s ARG 336 Ca 0.50 -0.19 -0.17 0.00 -0.13 0.00 0.00 55.73 55.75 1ui8 s ARG 336 Cb -0.29 -1.19 -0.05 0.00 -1.56 0.00 0.00 34.95 31.85 1ui8 s ARG 336 CO 0.38 -0.13 0.47 -2.00 -0.81 0.00 0.00 175.30 173.20 1ui8 s GLU 337 N 1.21 4.16 -0.80 5.12 2.12 -1.26 0.12 118.70 129.37 1ui8 s GLU 337 Ca -0.05 0.49 -0.14 0.00 0.36 0.00 0.00 54.97 55.63 1ui8 s GLU 337 Cb -0.14 -3.32 0.21 0.00 0.26 0.00 0.00 34.13 31.14 1ui8 s GLU 337 CO -0.02 0.45 0.74 0.42 -0.54 0.00 0.00 175.26 176.31 1ui8 s ILE 338 N -0.33 5.55 0.11 -3.70 1.01 0.46 -4.99 121.20 119.31 1ui8 s ILE 338 Ca 0.26 -2.41 -0.31 0.00 0.00 0.00 0.00 60.65 58.19 1ui8 s ILE 338 Cb -0.17 -4.44 -0.10 0.00 0.01 0.00 0.00 42.46 37.76 1ui8 s ILE 338 CO 0.13 -1.01 1.87 -1.14 0.00 0.00 0.00 174.94 174.79 1ui8 n ARG 339 N 4.06 2.84 -3.75 2.79 0.63 -1.26 -2.48 116.66 119.48 1ui8 n ARG 339 Ca 0.12 1.03 -0.26 0.00 -0.92 0.00 0.00 57.85 57.82 1ui8 n ARG 339 Cb 0.46 -2.94 0.05 0.00 0.45 0.00 0.00 32.46 30.48 1ui8 n ARG 339 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1ui8 n ASN 340 N 5.99 -4.09 0.07 6.15 3.02 -1.26 -4.16 115.26 120.97 1ui8 n ASN 340 Ca 0.18 -0.72 0.13 0.00 -0.03 0.00 0.00 54.58 54.14 1ui8 n ASN 340 Cb 0.38 -4.30 0.35 0.00 -0.61 0.00 0.00 39.78 35.60 1ui8 n ASN 340 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ui8 n GLY 341 N -1.69 -1.57 2.93 7.41 0.00 -1.04 -0.17 105.19 111.06 1ui8 n GLY 341 Ca -0.07 -0.12 -0.22 0.00 0.00 0.00 0.00 46.02 45.61 1ui8 n GLY 341 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ui8 s ILE 342 N -3.10 0.76 -0.11 -0.61 1.01 -0.65 -4.53 121.20 113.96 1ui8 s ILE 342 Ca 0.10 -0.24 -0.06 0.00 0.00 0.00 0.00 60.65 60.45 1ui8 s ILE 342 Cb 0.14 -0.75 -0.04 0.00 0.01 0.00 0.00 42.46 41.82 1ui8 s ILE 342 CO 0.63 0.28 0.11 0.00 0.00 0.00 0.00 174.94 175.96 1ui8 s MET 344 N -1.01 0.44 0.11 0.00 -1.94 0.06 -1.68 119.30 115.28 1ui8 s MET 344 Ca 0.15 0.12 -0.25 0.00 -1.71 0.00 0.00 55.69 54.00 1ui8 s MET 344 Cb -0.12 -0.76 0.07 0.00 2.01 0.00 0.00 34.83 36.04 1ui8 s MET 344 CO 0.04 -0.24 0.79 -3.38 -0.01 0.00 0.00 175.02 172.22 1ui8 s HIS 345 N 1.65 -0.34 -0.02 -0.03 -3.43 -0.92 -0.63 115.29 111.57 1ui8 s HIS 345 Ca -0.00 0.11 0.04 0.00 -0.80 0.00 0.00 55.06 54.41 1ui8 s HIS 345 Cb -0.13 0.59 -0.03 0.00 -1.43 0.00 0.00 32.58 31.58 1ui8 s HIS 345 CO -0.03 -0.78 -0.12 -1.83 -2.00 0.00 0.00 174.74 169.98 1ui8 s GLU 346 N -3.44 2.46 0.04 -0.38 -1.05 -1.26 -0.06 118.70 115.01 1ui8 s GLU 346 Ca 0.06 -0.74 0.03 0.00 -0.15 0.00 0.00 54.97 54.17 1ui8 s GLU 346 Cb -0.02 -2.40 -0.02 0.00 -0.44 0.00 0.00 34.13 31.25 1ui8 s GLU 346 CO -0.06 0.61 -0.09 -1.83 0.95 0.00 0.00 175.26 174.83 1ui8 s GLU 347 N -1.06 0.60 0.44 -4.83 -1.05 -0.11 -4.92 118.70 107.77 1ui8 s GLU 347 Ca 0.14 -0.74 -0.26 0.00 -0.15 0.00 0.00 54.97 53.96 1ui8 s GLU 347 Cb -0.11 -0.45 -0.09 0.00 -0.44 0.00 0.00 34.13 33.04 1ui8 s GLU 347 CO 0.03 0.09 1.44 -3.47 0.95 0.00 0.00 175.26 174.31 1ui8 n ASP 348 N 1.61 3.40 -2.57 0.83 2.03 -1.26 -0.93 116.55 119.66 1ui8 n ASP 348 Ca -0.21 1.14 -0.14 0.00 0.52 0.00 0.00 54.79 56.10 1ui8 n ASP 348 Cb 0.55 -1.61 0.03 0.00 -0.72 0.00 0.00 41.12 39.37 1ui8 n ASP 348 CO 0.00 0.00 0.00 1.87 -1.92 0.00 0.00 177.20 177.15 1ui8 n TRP 349 N -0.11 1.94 -4.84 -0.67 -0.00 0.09 -4.78 117.44 109.08 1ui8 n TRP 349 Ca 0.05 -2.68 0.00 0.00 -0.00 0.00 0.00 57.50 54.87 1ui8 n TRP 349 Cb 0.41 -0.27 0.00 0.00 -0.00 0.00 0.00 31.31 31.45 1ui8 n TRP 349 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1ui8 n GLY 350 N -0.35 1.03 3.72 5.87 0.00 -1.26 -4.34 105.19 109.86 1ui8 n GLY 350 Ca 0.20 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 1ui8 n GLY 350 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ui8 s ILE 351 N 0.00 4.49 -0.20 -0.61 -1.09 -1.26 0.11 121.20 122.64 1ui8 s ILE 351 Ca 0.00 1.90 -0.16 0.00 -2.23 0.00 0.00 60.65 60.16 1ui8 s ILE 351 Cb 0.00 -4.21 -0.20 0.00 -1.58 0.00 0.00 42.46 36.47 1ui8 s ILE 351 CO 0.00 0.21 0.14 -0.11 -1.23 0.00 0.00 174.94 173.95 1ui8 n LEU 352 N 3.42 2.13 -3.61 2.97 7.94 0.65 -4.58 117.00 125.92 1ui8 n LEU 352 Ca 0.05 0.33 -0.15 0.00 -1.11 0.00 0.00 56.01 55.13 1ui8 n LEU 352 Cb 0.49 -0.98 -0.07 0.00 0.53 0.00 0.00 43.42 43.39 1ui8 n LEU 352 CO 0.53 0.50 0.38 0.00 -1.11 0.00 0.00 177.39 177.68 1ui8 s ALA 353 N -2.44 -1.66 -0.20 1.96 0.00 -1.17 -4.98 121.76 113.26 1ui8 s ALA 353 Ca -0.29 1.64 -0.18 0.00 0.00 0.00 0.00 51.96 53.13 1ui8 s ALA 353 Cb 0.08 -0.68 0.05 0.00 0.00 0.00 0.00 23.12 22.57 1ui8 s ALA 353 CO 0.62 -0.33 0.54 0.21 0.00 0.00 0.00 175.76 176.79 1ui8 s LYS 354 N -0.24 0.61 -0.28 0.00 2.20 -1.26 -0.97 119.74 119.81 1ui8 s LYS 354 Ca -0.04 0.77 -0.16 0.00 -0.36 0.00 0.00 55.97 56.18 1ui8 s LYS 354 Cb -0.03 0.27 0.09 0.00 -1.51 0.00 0.00 37.83 36.65 1ui8 s LYS 354 CO 0.04 -0.08 0.73 -1.58 -0.36 0.00 0.00 175.35 174.09 1ui8 s HIS 355 N 0.43 -1.02 -0.36 4.03 2.46 -0.03 -5.01 115.29 115.79 1ui8 s HIS 355 Ca -0.01 2.02 -0.05 0.00 0.47 0.00 0.00 55.06 57.49 1ui8 s HIS 355 Cb -0.04 0.61 0.07 0.00 -0.13 0.00 0.00 32.58 33.09 1ui8 s HIS 355 CO -0.01 -0.51 0.13 -1.12 -2.47 0.00 0.00 174.74 170.76 1ui8 s SER 356 N 1.70 5.25 -0.26 9.88 0.01 -1.26 -0.58 113.70 128.43 1ui8 s SER 356 Ca -0.10 -1.48 -0.14 0.00 1.31 0.00 0.00 55.95 55.55 1ui8 s SER 356 Cb -0.05 -1.84 -0.04 0.00 0.21 0.00 0.00 66.02 64.30 1ui8 s SER 356 CO -0.19 -0.40 0.32 -0.62 0.41 0.00 0.00 173.24 172.75 1ui8 s ASP 357 N 1.61 6.23 0.08 2.44 -1.08 -0.50 -4.98 116.67 120.46 1ui8 s ASP 357 Ca 0.01 0.26 -0.27 0.00 -0.52 0.00 0.00 52.55 52.02 1ui8 s ASP 357 Cb -0.21 -2.19 -0.17 0.00 -1.46 0.00 0.00 42.92 38.89 1ui8 s ASP 357 CO -0.00 -0.11 1.66 0.25 0.52 0.00 0.00 175.17 177.48 1ui8 h LEU 358 N 8.27 -0.34 -0.80 -1.34 5.85 -1.96 -0.95 115.31 124.05 1ui8 h LEU 358 Ca -0.34 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.34 1ui8 h LEU 358 Cb 1.17 0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.25 1ui8 h LEU 358 CO 0.64 -0.22 0.36 -0.50 -0.34 0.00 0.00 178.44 178.38 1ui8 h TRP 359 N -0.43 1.17 0.00 1.25 6.55 -1.97 -3.13 115.95 119.38 1ui8 h TRP 359 Ca -0.04 -0.07 0.00 0.00 0.95 0.00 0.00 58.89 59.73 1ui8 h TRP 359 Cb 0.33 -0.36 0.00 0.00 -0.86 0.00 0.00 29.16 28.27 1ui8 h TRP 359 CO -0.05 0.86 -1.10 -1.13 -1.05 0.00 0.00 178.44 175.97 1ui8 n SER 360 N -4.33 0.73 0.00 -3.49 3.41 -1.23 -4.95 113.62 103.75 1ui8 n SER 360 Ca 0.07 0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.92 1ui8 n SER 360 Cb 0.15 0.63 0.00 0.00 -0.26 0.00 0.00 64.21 64.73 1ui8 n SER 360 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ui8 n GLY 361 N 1.21 0.80 3.69 5.00 0.00 -0.36 -5.00 105.19 110.54 1ui8 n GLY 361 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 1ui8 n GLY 361 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ui8 s ILE 362 N -3.30 5.06 -0.21 -0.61 1.01 -1.24 -4.89 121.20 117.02 1ui8 s ILE 362 Ca 0.00 1.22 -0.05 0.00 0.00 0.00 0.00 60.65 61.82 1ui8 s ILE 362 Cb 0.00 -3.95 -0.02 0.00 0.01 0.00 0.00 42.46 38.51 1ui8 s ILE 362 CO 0.00 0.20 -0.02 0.20 0.00 0.00 0.00 174.94 175.32 1ui8 s ASN 363 N 0.95 4.58 -0.06 3.58 0.01 -1.26 -1.41 114.94 121.33 1ui8 s ASN 363 Ca 0.31 -0.30 0.03 0.00 -0.71 0.00 0.00 52.86 52.19 1ui8 s ASN 363 Cb -0.16 -1.79 0.01 0.00 0.41 0.00 0.00 41.25 39.72 1ui8 s ASN 363 CO 0.13 0.02 -0.14 -0.47 -1.51 0.00 0.00 177.10 175.12 1ui8 s TYR 364 N 1.28 1.61 -0.08 2.20 6.14 0.25 -5.00 117.35 123.75 1ui8 s TYR 364 Ca 0.04 -0.58 -0.05 0.00 0.64 0.00 0.00 57.07 57.12 1ui8 s TYR 364 Cb -0.14 -1.14 0.03 0.00 0.42 0.00 0.00 41.96 41.13 1ui8 s TYR 364 CO -0.00 -0.27 0.19 0.99 0.64 0.00 0.00 175.55 177.10 1ui8 s THR 365 N 0.51 -0.03 0.02 4.34 2.01 -1.26 -0.86 115.64 120.37 1ui8 s THR 365 Ca -0.13 0.10 0.03 0.00 0.31 0.00 0.00 61.69 62.01 1ui8 s THR 365 Cb -0.15 -0.29 -0.01 0.00 0.01 0.00 0.00 72.50 72.06 1ui8 s THR 365 CO 0.04 0.04 -0.11 -0.13 -0.69 0.00 0.00 174.62 173.78 1ui8 s ARG 366 N 0.80 0.77 0.31 4.92 1.81 -0.14 -4.69 118.95 122.72 1ui8 s ARG 366 Ca -0.06 -0.55 -0.08 0.00 -1.72 0.00 0.00 55.73 53.33 1ui8 s ARG 366 Cb -0.07 -0.73 -0.06 0.00 -0.45 0.00 0.00 34.95 33.64 1ui8 s ARG 366 CO -0.04 0.19 0.62 1.03 -0.68 0.00 0.00 175.30 176.41 1ui8 s ARG 367 N -0.76 3.72 0.33 3.54 1.81 -1.26 -0.25 118.95 126.08 1ui8 s ARG 367 Ca 0.01 0.22 0.08 0.00 -1.72 0.00 0.00 55.73 54.31 1ui8 s ARG 367 Cb -0.06 -2.57 -0.03 0.00 -0.45 0.00 0.00 34.95 31.84 1ui8 s ARG 367 CO 0.00 0.16 0.25 1.21 -0.68 0.00 0.00 175.30 176.24 1ui8 s ASN 368 N -2.96 5.19 0.08 0.23 2.47 0.12 -4.44 114.94 115.63 1ui8 s ASN 368 Ca 0.47 -0.52 -0.24 0.00 0.42 0.00 0.00 52.86 52.99 1ui8 s ASN 368 Cb -0.11 -0.98 0.06 0.00 -1.45 0.00 0.00 41.25 38.78 1ui8 s ASN 368 CO 0.28 -0.30 0.58 0.00 -3.72 0.00 0.00 177.10 173.94 1ui8 s ARG 369 N -3.94 1.15 0.04 0.43 1.70 -1.26 -0.73 118.95 116.33 1ui8 s ARG 369 Ca 0.39 -0.27 0.04 0.00 -0.47 0.00 0.00 55.73 55.42 1ui8 s ARG 369 Cb -0.05 0.53 -0.02 0.00 -0.57 0.00 0.00 34.95 34.83 1ui8 s ARG 369 CO 0.25 -0.45 -0.11 -0.98 -1.08 0.00 0.00 175.30 172.94 1ui8 s ARG 370 N -2.85 0.72 -0.12 3.89 1.70 -0.10 -3.13 118.95 119.05 1ui8 s ARG 370 Ca -0.03 -0.74 -0.16 0.00 -0.47 0.00 0.00 55.73 54.33 1ui8 s ARG 370 Cb -0.00 -0.65 -0.05 0.00 -0.57 0.00 0.00 34.95 33.68 1ui8 s ARG 370 CO -0.05 0.15 0.39 1.41 -1.08 0.00 0.00 175.30 176.12 1ui8 s MET 371 N -1.30 4.25 -0.09 3.89 -2.45 0.60 -0.93 119.30 123.27 1ui8 s MET 371 Ca -0.03 0.29 0.03 0.00 -1.25 0.00 0.00 55.69 54.73 1ui8 s MET 371 Cb -0.08 -3.41 -0.02 0.00 1.25 0.00 0.00 34.83 32.58 1ui8 s MET 371 CO 0.01 0.26 -0.17 0.08 1.05 0.00 0.00 175.02 176.24 1ui8 s VAL 372 N 0.35 2.71 -0.13 10.11 1.01 0.91 -1.32 120.40 134.05 1ui8 s VAL 372 Ca 0.22 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 1ui8 s VAL 372 Cb -0.14 -2.07 0.03 0.00 0.00 0.00 0.00 36.38 34.20 1ui8 s VAL 372 CO 0.08 0.56 -0.06 -0.63 0.00 0.00 0.00 175.10 175.05 1ui8 s ILE 373 N -0.08 0.96 0.18 2.22 1.01 -0.57 -2.16 121.20 122.77 1ui8 s ILE 373 Ca -0.04 -0.37 -0.07 0.00 0.00 0.00 0.00 60.65 60.17 1ui8 s ILE 373 Cb -0.14 -1.07 -0.02 0.00 0.01 0.00 0.00 42.46 41.24 1ui8 s ILE 373 CO 0.04 0.26 0.27 -0.94 0.00 0.00 0.00 174.94 174.57 1ui8 s SER 374 N 1.72 0.06 0.13 3.58 1.04 -0.67 -1.15 113.70 118.40 1ui8 s SER 374 Ca 0.03 -1.01 -0.16 0.00 0.48 0.00 0.00 55.95 55.29 1ui8 s SER 374 Cb -0.14 0.44 0.03 0.00 0.10 0.00 0.00 66.02 66.46 1ui8 s SER 374 CO -0.08 -0.92 0.40 0.72 0.98 0.00 0.00 173.24 174.35 1ui8 s PHE 375 N -4.02 -0.20 -0.02 5.02 -0.71 -0.95 -0.96 117.98 116.15 1ui8 s PHE 375 Ca 0.23 -0.12 0.05 0.00 -1.04 0.00 0.00 56.93 56.04 1ui8 s PHE 375 Cb 0.04 0.26 -0.01 0.00 -1.21 0.00 0.00 43.02 42.09 1ui8 s PHE 375 CO 0.04 -0.70 -0.16 0.12 -1.34 0.00 0.00 175.22 173.18 1ui8 s PHE 376 N -3.81 1.42 0.17 3.49 2.19 -1.26 -1.22 117.98 118.96 1ui8 s PHE 376 Ca 0.03 -0.29 0.07 0.00 0.33 0.00 0.00 56.93 57.08 1ui8 s PHE 376 Cb 0.02 -0.92 -0.04 0.00 -1.31 0.00 0.00 43.02 40.76 1ui8 s PHE 376 CO -0.12 -0.04 -0.15 -0.08 1.83 0.00 0.00 175.22 176.66 1ui8 s THR 377 N -0.31 1.62 -0.10 0.12 -1.32 0.56 0.13 115.64 116.34 1ui8 s THR 377 Ca 0.05 -1.99 0.01 0.00 -1.21 0.00 0.00 61.69 58.54 1ui8 s THR 377 Cb -0.07 -1.84 0.02 0.00 -1.51 0.00 0.00 72.50 69.10 1ui8 s THR 377 CO -0.00 -0.48 -0.10 -0.89 -2.21 0.00 0.00 174.62 170.94 1ui8 s THR 378 N -2.51 1.14 -0.38 5.08 2.01 -1.10 -1.00 115.64 118.87 1ui8 s THR 378 Ca 0.17 -0.40 0.02 0.00 0.31 0.00 0.00 61.69 61.79 1ui8 s THR 378 Cb -0.03 -1.10 0.11 0.00 0.01 0.00 0.00 72.50 71.49 1ui8 s THR 378 CO 0.05 0.38 0.14 -0.63 -0.69 0.00 0.00 174.62 173.87 1ui8 s ILE 379 N 1.34 1.78 0.00 1.82 -1.09 -1.26 -4.79 121.20 119.00 1ui8 s ILE 379 Ca -0.01 -2.31 0.00 0.00 -2.23 0.00 0.00 60.65 56.10 1ui8 s ILE 379 Cb -0.14 -2.29 0.00 0.00 -1.58 0.00 0.00 42.46 38.45 1ui8 s ILE 379 CO -0.05 -0.72 0.00 0.61 -1.23 0.00 0.00 174.94 173.56 1ui8 n GLY 380 N 4.06 2.93 1.29 6.18 0.00 -1.26 -4.74 105.19 113.64 1ui8 n GLY 380 Ca 0.03 0.08 -0.02 0.00 0.00 0.00 0.00 46.02 46.11 1ui8 n GLY 380 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ui8 n ASN 381 N 9.91 4.11 0.00 1.61 6.94 -1.26 -5.00 115.26 131.57 1ui8 n ASN 381 Ca 0.00 -2.28 0.00 0.00 -0.02 0.00 0.00 54.58 52.28 1ui8 n ASN 381 Cb 0.00 -0.78 0.00 0.00 -2.36 0.00 0.00 39.78 36.64 1ui8 n ASN 381 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 1ui8 n ASP 383 N 0.80 0.00 -4.08 0.53 9.92 -1.04 -0.68 116.55 122.00 1ui8 n ASP 383 Ca 0.04 0.00 -0.24 0.00 -0.53 0.00 0.00 54.79 54.06 1ui8 n ASP 383 Cb 0.55 0.00 -0.16 0.00 -0.64 0.00 0.00 41.12 40.87 1ui8 n ASP 383 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1ui8 s TYR 384 N -0.03 1.42 -0.14 1.24 2.02 -0.17 -1.11 117.35 120.58 1ui8 s TYR 384 Ca 0.00 -0.39 -0.04 0.00 -0.37 0.00 0.00 57.07 56.27 1ui8 s TYR 384 Cb 0.00 -0.97 -0.03 0.00 -0.40 0.00 0.00 41.96 40.56 1ui8 s TYR 384 CO 0.00 -0.14 -0.01 0.20 -1.57 0.00 0.00 175.55 174.03 1ui8 s GLY 385 N 0.11 1.78 -0.20 0.71 0.00 0.55 -0.32 107.32 109.95 1ui8 s GLY 385 Ca -0.04 -0.81 -0.02 0.00 0.00 0.00 0.00 44.72 43.86 1ui8 s GLY 385 CO 0.01 -0.20 -0.09 -1.36 0.00 0.00 0.00 173.10 171.47 1ui8 s PHE 386 N 0.01 2.90 -0.07 1.90 0.40 -0.36 -0.49 117.98 122.27 1ui8 s PHE 386 Ca 0.02 -1.04 0.03 0.00 -0.60 0.00 0.00 56.93 55.34 1ui8 s PHE 386 Cb -0.13 -2.02 0.01 0.00 0.51 0.00 0.00 43.02 41.39 1ui8 s PHE 386 CO 0.02 -0.55 -0.14 0.71 0.70 0.00 0.00 175.22 175.97 1ui8 s TYR 387 N 1.25 1.57 -0.09 0.36 1.51 -0.24 -2.23 117.35 119.48 1ui8 s TYR 387 Ca 0.03 -0.57 0.02 0.00 -1.01 0.00 0.00 57.07 55.53 1ui8 s TYR 387 Cb -0.14 -1.13 -0.02 0.00 -0.11 0.00 0.00 41.96 40.56 1ui8 s TYR 387 CO -0.04 -0.27 -0.13 -1.58 -1.11 0.00 0.00 175.55 172.41 1ui8 s TRP 388 N 0.56 2.77 -0.01 2.71 0.52 -0.30 -1.06 118.94 124.13 1ui8 s TRP 388 Ca -0.14 -0.39 0.06 0.00 0.02 0.00 0.00 56.10 55.65 1ui8 s TRP 388 Cb -0.15 -1.74 -0.01 0.00 -1.15 0.00 0.00 33.47 30.41 1ui8 s TRP 388 CO 0.04 -0.00 -0.18 0.71 0.02 0.00 0.00 176.95 177.54 1ui8 s TYR 389 N -0.20 1.59 -0.12 -1.98 2.02 0.43 -1.52 117.35 117.59 1ui8 s TYR 389 Ca 0.00 -0.31 0.02 0.00 -0.37 0.00 0.00 57.07 56.42 1ui8 s TYR 389 Cb -0.13 -1.02 0.01 0.00 -0.40 0.00 0.00 41.96 40.42 1ui8 s TYR 389 CO 0.03 -0.02 -0.19 -0.51 -1.57 0.00 0.00 175.55 173.29 1ui8 s LEU 390 N -0.48 1.92 0.23 -1.29 1.43 -0.43 -1.35 118.68 118.69 1ui8 s LEU 390 Ca 0.07 -0.51 0.06 0.00 -1.03 0.00 0.00 54.13 52.72 1ui8 s LEU 390 Cb -0.07 -1.26 -0.04 0.00 0.03 0.00 0.00 46.19 44.86 1ui8 s LEU 390 CO -0.00 0.06 0.20 -0.31 0.23 0.00 0.00 176.35 176.53 1ui8 s TYR 391 N 0.80 3.17 0.25 0.29 2.02 -0.23 -0.29 117.35 123.36 1ui8 s TYR 391 Ca -0.09 -0.07 -0.03 0.00 -0.37 0.00 0.00 57.07 56.51 1ui8 s TYR 391 Cb -0.16 -1.45 0.47 0.00 -0.40 0.00 0.00 41.96 40.42 1ui8 s TYR 391 CO 0.00 0.51 1.78 -0.07 -1.57 0.00 0.00 175.55 176.21 1ui8 h LEU 392 N 1.70 0.58 0.00 -1.29 3.38 -1.87 -1.71 115.31 116.10 1ui8 h LEU 392 Ca -0.49 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1ui8 h LEU 392 Cb 1.23 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1ui8 h LEU 392 CO 0.62 0.29 0.00 -0.90 0.09 0.00 0.00 178.44 178.53 1ui8 n ASP 393 N -4.82 0.00 0.00 -0.43 5.75 -1.26 -4.78 116.55 111.01 1ui8 n ASP 393 Ca 0.15 -0.84 0.00 0.00 -0.01 0.00 0.00 54.79 54.10 1ui8 n ASP 393 Cb 0.36 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.45 1ui8 n ASP 393 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ui8 n GLY 394 N 0.47 0.42 3.75 6.12 0.00 -0.64 -4.79 105.19 110.52 1ui8 n GLY 394 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 1ui8 n GLY 394 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ui8 s THR 395 N -2.00 3.62 -0.08 2.61 2.01 -1.25 -4.47 115.64 116.07 1ui8 s THR 395 Ca 0.00 1.58 0.04 0.00 0.31 0.00 0.00 61.69 63.62 1ui8 s THR 395 Cb 0.00 -4.01 -0.01 0.00 0.01 0.00 0.00 72.50 68.49 1ui8 s THR 395 CO 0.00 0.36 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.46 1ui8 s ILE 396 N -0.98 2.53 0.01 1.82 1.01 -0.64 -1.06 121.20 123.88 1ui8 s ILE 396 Ca 0.45 -0.88 -0.02 0.00 0.00 0.00 0.00 60.65 60.19 1ui8 s ILE 396 Cb -0.31 -1.98 -0.01 0.00 0.01 0.00 0.00 42.46 40.17 1ui8 s ILE 396 CO 0.39 0.56 0.03 -0.70 0.00 0.00 0.00 174.94 175.22 1ui8 s GLU 397 N -0.10 0.32 0.04 2.79 2.12 -0.46 -0.35 118.70 123.07 1ui8 s GLU 397 Ca -0.04 -0.44 0.08 0.00 0.36 0.00 0.00 54.97 54.93 1ui8 s GLU 397 Cb -0.14 0.12 -0.03 0.00 0.26 0.00 0.00 34.13 34.35 1ui8 s GLU 397 CO 0.04 -0.06 -0.24 0.12 -0.54 0.00 0.00 175.26 174.58 1ui8 s PHE 398 N -1.20 2.08 -0.07 5.30 5.36 -0.67 -0.42 117.98 128.35 1ui8 s PHE 398 Ca -0.13 -0.39 -0.03 0.00 -0.96 0.00 0.00 56.93 55.42 1ui8 s PHE 398 Cb -0.08 -1.26 0.04 0.00 -0.34 0.00 0.00 43.02 41.39 1ui8 s PHE 398 CO -0.00 0.09 0.15 -2.00 -1.46 0.00 0.00 175.22 172.00 1ui8 s GLU 399 N -1.11 0.07 -0.13 10.12 2.12 -0.22 -2.29 118.70 127.25 1ui8 s GLU 399 Ca 0.10 0.45 -0.06 0.00 0.36 0.00 0.00 54.97 55.82 1ui8 s GLU 399 Cb -0.09 -0.22 -0.04 0.00 0.26 0.00 0.00 34.13 34.04 1ui8 s GLU 399 CO 0.02 -0.22 0.08 0.00 -0.54 0.00 0.00 175.26 174.59 1ui8 s ALA 400 N 1.63 3.58 -0.23 6.30 0.00 0.11 -1.08 121.76 132.07 1ui8 s ALA 400 Ca -0.04 -0.72 -0.00 0.00 0.00 0.00 0.00 51.96 51.20 1ui8 s ALA 400 Cb -0.12 -1.82 0.03 0.00 0.00 0.00 0.00 23.12 21.21 1ui8 s ALA 400 CO -0.06 0.47 -0.11 0.15 0.00 0.00 0.00 175.76 176.22 1ui8 s LYS 401 N -0.56 2.80 -0.21 0.00 1.02 0.36 -2.49 119.74 120.65 1ui8 s LYS 401 Ca 0.11 -0.99 -0.10 0.00 0.02 0.00 0.00 55.97 55.02 1ui8 s LYS 401 Cb -0.12 -2.85 -0.05 0.00 -0.52 0.00 0.00 37.83 34.29 1ui8 s LYS 401 CO 0.02 -0.37 0.13 0.00 -0.92 0.00 0.00 175.35 174.22 1ui8 s ALA 402 N 1.28 3.63 0.00 5.17 0.00 -0.24 -0.33 121.76 131.27 1ui8 s ALA 402 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.19 1ui8 s ALA 402 Cb -0.16 -2.19 0.00 0.00 0.00 0.00 0.00 23.12 20.76 1ui8 s ALA 402 CO -0.07 0.03 0.00 -2.37 0.00 0.00 0.00 175.76 173.36 1ui8 n THR 403 N 3.80 0.00 0.00 0.00 5.66 -0.27 -1.73 114.28 121.74 1ui8 n THR 403 Ca -0.16 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.84 1ui8 n THR 403 Cb 0.52 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 1ui8 n THR 403 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1ui8 n GLY 404 N 0.00 -0.30 3.33 1.09 0.00 -1.26 -2.49 105.19 105.56 1ui8 n GLY 404 Ca 0.00 -1.96 -0.32 0.00 0.00 0.00 0.00 46.02 43.74 1ui8 n GLY 404 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ui8 s VAL 405 N 0.00 2.54 0.40 1.61 1.01 0.15 -1.30 120.40 124.81 1ui8 s VAL 405 Ca 0.00 -0.87 -0.27 0.00 0.00 0.00 0.00 61.98 60.84 1ui8 s VAL 405 Cb 0.00 -2.00 -0.10 0.00 0.00 0.00 0.00 36.38 34.28 1ui8 s VAL 405 CO 0.00 0.56 1.48 -0.69 0.00 0.00 0.00 175.10 176.44 1ui8 s VAL 406 N -0.01 2.03 -0.01 2.92 1.01 -1.26 -4.76 120.40 120.32 1ui8 s VAL 406 Ca -0.06 0.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.65 1ui8 s VAL 406 Cb -0.15 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 1ui8 s VAL 406 CO 0.05 0.01 1.11 0.12 0.00 0.00 0.00 175.10 176.38 1ui8 s PHE 407 N -1.14 3.45 0.42 5.22 5.36 -1.26 -5.00 117.98 125.03 1ui8 s PHE 407 Ca 0.55 1.44 0.08 0.00 -0.96 0.00 0.00 56.93 58.04 1ui8 s PHE 407 Cb -0.46 -3.30 -0.01 0.00 -0.34 0.00 0.00 43.02 38.91 1ui8 s PHE 407 CO 0.62 -0.75 0.43 0.95 -1.46 0.00 0.00 175.22 175.00 1ui8 s THR 408 N 1.50 2.72 0.23 0.12 -4.23 -1.26 -4.09 115.64 110.63 1ui8 s THR 408 Ca 0.54 -1.26 -0.06 0.00 -1.18 0.00 0.00 61.69 59.73 1ui8 s THR 408 Cb -0.24 -2.98 0.02 0.00 1.34 0.00 0.00 72.50 70.64 1ui8 s THR 408 CO 0.25 0.00 0.41 -1.54 -0.54 0.00 0.00 174.62 173.20 1ui8 n SER 409 N -1.63 -1.17 -4.85 3.99 3.41 -0.21 -4.88 113.62 108.28 1ui8 n SER 409 Ca 0.05 -2.05 -0.32 0.00 -0.26 0.00 0.00 58.87 56.29 1ui8 n SER 409 Cb 0.61 2.01 -0.06 0.00 -0.26 0.00 0.00 64.21 66.52 1ui8 n SER 409 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ui8 s ALA 410 N -1.92 3.25 -0.29 7.33 0.00 -1.26 -0.42 121.76 128.44 1ui8 s ALA 410 Ca 0.13 0.08 -0.16 0.00 0.00 0.00 0.00 51.96 52.01 1ui8 s ALA 410 Cb -0.02 -2.85 -0.03 0.00 0.00 0.00 0.00 23.12 20.22 1ui8 s ALA 410 CO 0.10 0.20 0.41 0.12 0.00 0.00 0.00 175.76 176.59 1ui8 s PHE 411 N -2.12 3.23 0.42 0.00 5.36 0.28 -4.14 117.98 121.02 1ui8 s PHE 411 Ca 0.56 0.34 -0.25 0.00 -0.96 0.00 0.00 56.93 56.61 1ui8 s PHE 411 Cb -0.10 -2.66 -0.10 0.00 -0.34 0.00 0.00 43.02 39.82 1ui8 s PHE 411 CO 0.20 -0.32 1.22 -2.30 -1.46 0.00 0.00 175.22 172.56 1ui8 n PRO 412 N 5.43 1.80 -2.13 10.12 -0.02 -1.26 -4.82 135.00 144.13 1ui8 n PRO 412 Ca -0.07 0.64 -0.42 0.00 -2.02 0.00 0.00 63.50 61.63 1ui8 n PRO 412 Cb 0.50 -2.31 -0.03 0.00 -0.02 0.00 0.00 33.50 31.64 1ui8 n PRO 412 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1ui8 s GLU 413 N -2.17 4.27 0.00 -0.52 2.12 -1.26 -1.80 118.70 119.33 1ui8 s GLU 413 Ca 0.62 2.10 0.00 0.00 0.36 0.00 0.00 54.97 58.04 1ui8 s GLU 413 Cb -0.52 -3.48 0.00 0.00 0.26 0.00 0.00 34.13 30.39 1ui8 s GLU 413 CO 0.58 -0.58 0.00 0.41 -0.54 0.00 0.00 175.26 175.12 1ui8 n GLY 414 N 3.70 0.79 2.73 -1.50 0.00 -1.26 -4.97 105.19 104.67 1ui8 n GLY 414 Ca 0.13 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.16 1ui8 n GLY 414 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ui8 n GLY 415 N -2.05 -2.16 3.47 -0.02 0.00 -0.74 -5.02 105.19 98.66 1ui8 n GLY 415 Ca 0.00 -1.47 -0.16 0.00 0.00 0.00 0.00 46.02 44.39 1ui8 n GLY 415 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ui8 s SER 416 N -2.98 -0.57 0.00 1.61 0.15 -1.26 -4.62 113.70 106.03 1ui8 s SER 416 Ca 0.00 0.78 0.26 0.00 0.70 0.00 0.00 55.95 57.69 1ui8 s SER 416 Cb 0.00 0.74 0.76 0.00 -1.71 0.00 0.00 66.02 65.80 1ui8 s SER 416 CO 0.00 -0.45 1.57 0.47 1.20 0.00 0.00 173.24 176.03 1ui8 n ASP 417 N 1.57 0.76 -0.05 5.45 8.00 -1.26 -4.23 116.55 126.79 1ui8 n ASP 417 Ca -0.18 -0.61 0.01 0.00 0.71 0.00 0.00 54.79 54.72 1ui8 n ASP 417 Cb 0.56 0.12 0.01 0.00 -0.02 0.00 0.00 41.12 41.80 1ui8 n ASP 417 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1ui8 n ASN 418 N -0.97 1.01 -3.80 -2.24 4.13 -1.26 -5.05 115.26 107.09 1ui8 n ASN 418 Ca 0.10 -1.68 -0.13 0.00 1.68 0.00 0.00 54.58 54.56 1ui8 n ASN 418 Cb 0.33 -0.06 -0.11 0.00 -1.54 0.00 0.00 39.78 38.41 1ui8 n ASN 418 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1ui8 s ILE 419 N -0.66 0.03 0.13 2.41 1.01 -1.26 -1.56 121.20 121.29 1ui8 s ILE 419 Ca 0.03 -0.21 0.07 0.00 0.00 0.00 0.00 60.65 60.53 1ui8 s ILE 419 Cb 0.02 -0.42 -0.04 0.00 0.01 0.00 0.00 42.46 42.04 1ui8 s ILE 419 CO 0.00 -0.12 -0.05 -0.94 0.00 0.00 0.00 174.94 173.83 1ui8 s SER 420 N -0.41 4.61 -0.07 3.58 1.04 -0.55 -4.45 113.70 117.45 1ui8 s SER 420 Ca -0.05 -0.36 -0.22 0.00 0.48 0.00 0.00 55.95 55.80 1ui8 s SER 420 Cb -0.03 -0.95 -0.04 0.00 0.10 0.00 0.00 66.02 65.10 1ui8 s SER 420 CO 0.01 0.15 0.63 -1.58 0.98 0.00 0.00 173.24 173.43 1ui8 s GLN 421 N -2.47 4.40 -0.16 4.02 0.74 -1.26 -0.71 119.66 124.22 1ui8 s GLN 421 Ca 0.24 0.75 0.06 0.00 0.05 0.00 0.00 55.36 56.46 1ui8 s GLN 421 Cb -0.11 -3.43 -0.14 0.00 1.10 0.00 0.00 33.01 30.43 1ui8 s GLN 421 CO 0.16 0.14 -0.07 1.28 -0.55 0.00 0.00 175.29 176.25 1ui8 n LEU 422 N 3.59 1.66 -3.96 3.68 4.77 -0.17 -4.45 117.00 122.12 1ui8 n LEU 422 Ca -0.04 -0.05 -0.09 0.00 -0.03 0.00 0.00 56.01 55.80 1ui8 n LEU 422 Cb 0.51 -0.20 -0.04 0.00 -2.33 0.00 0.00 43.42 41.37 1ui8 n LEU 422 CO 0.46 0.60 0.27 0.00 -1.33 0.00 0.00 177.39 177.38 1ui8 s ALA 423 N -2.35 -0.38 -0.18 -1.18 0.00 -1.23 -4.75 121.76 111.69 1ui8 s ALA 423 Ca -0.17 -0.82 -0.33 0.00 0.00 0.00 0.00 51.96 50.65 1ui8 s ALA 423 Cb 0.05 1.00 -0.10 0.00 0.00 0.00 0.00 23.12 24.07 1ui8 s ALA 423 CO 0.49 -0.90 2.03 -2.30 0.00 0.00 0.00 175.76 175.08 1ui8 n PRO 424 N -0.43 1.88 -0.43 0.00 -0.02 -1.26 -1.15 135.00 133.60 1ui8 n PRO 424 Ca -0.02 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 1ui8 n PRO 424 Cb 0.61 -2.73 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 1ui8 n PRO 424 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ui8 n GLY 425 N 5.21 1.83 3.68 -1.23 0.00 -1.26 -4.59 105.19 108.83 1ui8 n GLY 425 Ca 0.29 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.93 1ui8 n GLY 425 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ui8 s LEU 426 N 0.00 4.16 0.28 0.99 2.96 -0.30 -0.55 118.68 126.22 1ui8 s LEU 426 Ca 0.00 0.42 0.10 0.00 -0.22 0.00 0.00 54.13 54.43 1ui8 s LEU 426 Cb 0.00 -2.39 -0.05 0.00 0.50 0.00 0.00 46.19 44.25 1ui8 s LEU 426 CO 0.00 -0.01 -0.04 -0.83 -1.32 0.00 0.00 176.35 174.16 1ui8 s GLY 427 N 0.93 1.77 -0.27 7.98 0.00 0.44 -1.00 107.32 117.17 1ui8 s GLY 427 Ca 0.16 -1.75 -0.02 0.00 0.00 0.00 0.00 44.72 43.11 1ui8 s GLY 427 CO 0.06 -1.80 0.08 0.00 0.00 0.00 0.00 173.10 171.45 1ui8 s ALA 428 N -2.39 1.16 0.36 3.20 0.00 0.11 -1.04 121.76 123.15 1ui8 s ALA 428 Ca 0.32 -1.21 -0.28 0.00 0.00 0.00 0.00 51.96 50.79 1ui8 s ALA 428 Cb -0.05 -1.42 -0.10 0.00 0.00 0.00 0.00 23.12 21.54 1ui8 s ALA 428 CO 0.19 -1.50 1.38 -1.25 0.00 0.00 0.00 175.76 174.58 1ui8 s PRO 429 N 1.80 4.19 0.54 0.00 0.04 -1.26 -1.48 135.00 138.84 1ui8 s PRO 429 Ca 0.06 2.35 -0.21 0.00 0.04 0.00 0.00 61.00 63.23 1ui8 s PRO 429 Cb -0.17 -2.98 -0.05 0.00 0.04 0.00 0.00 34.50 31.34 1ui8 s PRO 429 CO -0.22 -0.37 1.28 -0.06 0.04 0.00 0.00 177.00 177.66 1ui8 s PHE 430 N -1.15 2.45 0.27 0.56 0.08 -0.60 -4.85 117.98 114.74 1ui8 s PHE 430 Ca 0.52 1.45 -0.20 0.00 0.12 0.00 0.00 56.93 58.82 1ui8 s PHE 430 Cb -0.42 -3.63 0.06 0.00 -0.57 0.00 0.00 43.02 38.46 1ui8 s PHE 430 CO 0.56 -2.41 0.89 -3.38 -0.10 0.00 0.00 175.22 170.78 1ui8 s HIS 431 N -1.42 0.03 0.11 0.36 -3.43 -1.05 0.05 115.29 109.93 1ui8 s HIS 431 Ca 0.71 -0.53 0.04 0.00 -0.80 0.00 0.00 55.06 54.48 1ui8 s HIS 431 Cb -0.35 0.75 -0.04 0.00 -1.43 0.00 0.00 32.58 31.51 1ui8 s HIS 431 CO 0.41 -1.21 -0.10 -0.65 -2.00 0.00 0.00 174.74 171.19 1ui8 s GLN 432 N -2.60 0.90 -0.30 -0.38 -0.21 -0.55 -0.42 119.66 116.09 1ui8 s GLN 432 Ca 0.17 -1.21 0.03 0.00 0.02 0.00 0.00 55.36 54.36 1ui8 s GLN 432 Cb -0.04 -0.57 0.08 0.00 1.00 0.00 0.00 33.01 33.48 1ui8 s GLN 432 CO 0.07 0.09 -0.01 -1.01 -2.12 0.00 0.00 175.29 172.31 1ui8 s HIS 433 N -2.58 3.30 -0.16 0.91 3.76 0.07 -3.15 115.29 117.44 1ui8 s HIS 433 Ca 0.08 -2.56 -0.01 0.00 -0.15 0.00 0.00 55.06 52.42 1ui8 s HIS 433 Cb -0.02 -2.37 -0.01 0.00 1.11 0.00 0.00 32.58 31.29 1ui8 s HIS 433 CO 0.00 -0.90 -0.12 0.42 -0.85 0.00 0.00 174.74 173.29 1ui8 s ILE 434 N 1.07 2.98 0.25 0.60 1.01 -0.01 -0.62 121.20 126.48 1ui8 s ILE 434 Ca 0.03 -0.66 0.07 0.00 0.00 0.00 0.00 60.65 60.09 1ui8 s ILE 434 Cb -0.19 -2.28 -0.04 0.00 0.01 0.00 0.00 42.46 39.96 1ui8 s ILE 434 CO -0.08 0.50 0.15 -0.36 0.00 0.00 0.00 174.94 175.15 1ui8 s PHE 435 N 0.78 3.02 -0.15 3.97 0.40 0.56 -0.39 117.98 126.16 1ui8 s PHE 435 Ca -0.05 -0.13 -0.01 0.00 -0.60 0.00 0.00 56.93 56.14 1ui8 s PHE 435 Cb -0.15 -1.36 0.04 0.00 0.51 0.00 0.00 43.02 42.06 1ui8 s PHE 435 CO 0.01 0.54 -0.01 0.45 0.70 0.00 0.00 175.22 176.91 1ui8 s SER 436 N -3.76 2.50 -0.20 1.36 0.15 -0.44 -1.87 113.70 111.43 1ui8 s SER 436 Ca 0.32 -0.54 -0.15 0.00 0.70 0.00 0.00 55.95 56.28 1ui8 s SER 436 Cb -0.08 -0.69 -0.04 0.00 -1.71 0.00 0.00 66.02 63.50 1ui8 s SER 436 CO 0.24 -0.22 0.37 0.00 1.20 0.00 0.00 173.24 174.83 1ui8 s ALA 437 N 1.79 3.56 -0.32 5.45 0.00 -0.16 -0.31 121.76 131.77 1ui8 s ALA 437 Ca 0.02 -0.54 -0.11 0.00 0.00 0.00 0.00 51.96 51.32 1ui8 s ALA 437 Cb -0.15 -2.59 -0.02 0.00 0.00 0.00 0.00 23.12 20.36 1ui8 s ALA 437 CO -0.07 -0.26 0.19 0.50 0.00 0.00 0.00 175.76 176.12 1ui8 s ARG 438 N 1.22 3.51 -0.32 0.00 3.52 0.21 -1.04 118.95 126.05 1ui8 s ARG 438 Ca 0.18 -0.61 0.02 0.00 -0.13 0.00 0.00 55.73 55.19 1ui8 s ARG 438 Cb -0.15 -3.67 0.09 0.00 -1.56 0.00 0.00 34.95 29.66 1ui8 s ARG 438 CO 0.07 -0.38 0.03 -0.51 -0.81 0.00 0.00 175.30 173.70 1ui8 s LEU 439 N 1.68 4.40 -0.76 -0.88 1.43 0.10 -2.18 118.68 122.47 1ui8 s LEU 439 Ca 0.06 -1.84 -0.25 0.00 -1.03 0.00 0.00 54.13 51.06 1ui8 s LEU 439 Cb -0.17 -1.65 0.04 0.00 0.03 0.00 0.00 46.19 44.44 1ui8 s LEU 439 CO 0.09 -0.34 1.23 -0.62 0.23 0.00 0.00 176.35 176.94 1ui8 s ASP 440 N 1.13 6.21 0.50 2.29 2.15 0.09 -0.21 116.67 128.84 1ui8 s ASP 440 Ca 0.03 -0.72 -0.21 0.00 0.43 0.00 0.00 52.55 52.09 1ui8 s ASP 440 Cb -0.20 -2.53 -0.07 0.00 -0.30 0.00 0.00 42.92 39.82 1ui8 s ASP 440 CO -0.06 -1.70 1.10 -0.04 -0.17 0.00 0.00 175.17 174.30 1ui8 s MET 441 N 5.23 3.63 -0.40 4.34 -1.94 -1.02 0.26 119.30 129.40 1ui8 s MET 441 Ca 0.34 1.55 0.10 0.00 -1.71 0.00 0.00 55.69 55.97 1ui8 s MET 441 Cb -0.09 -2.14 0.37 0.00 2.01 0.00 0.00 34.83 34.98 1ui8 s MET 441 CO 0.10 -0.61 1.12 0.00 -0.01 0.00 0.00 175.02 175.62 1ui8 n ALA 442 N -0.96 1.09 -1.85 3.03 0.00 -0.35 -4.50 120.51 116.97 1ui8 n ALA 442 Ca 0.10 -1.98 -0.39 0.00 0.00 0.00 0.00 53.44 51.17 1ui8 n ALA 442 Cb 0.51 -1.03 -0.03 0.00 0.00 0.00 0.00 19.45 18.90 1ui8 n ALA 442 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ui8 s ILE 443 N -0.75 3.24 -1.57 0.00 -1.09 -1.04 -2.28 121.20 117.71 1ui8 s ILE 443 Ca 0.26 0.17 -0.01 0.00 -2.23 0.00 0.00 60.65 58.83 1ui8 s ILE 443 Cb 0.37 -3.55 0.00 0.00 -1.58 0.00 0.00 42.46 37.70 1ui8 s ILE 443 CO -0.05 -0.50 0.11 0.47 -1.23 0.00 0.00 174.94 173.73 1ui8 n ASP 444 N 13.40 -5.43 0.00 3.58 8.00 0.86 -4.47 116.55 132.48 1ui8 n ASP 444 Ca 0.27 -0.02 0.00 0.00 0.71 0.00 0.00 54.79 55.74 1ui8 n ASP 444 Cb 0.52 -4.51 0.00 0.00 -0.02 0.00 0.00 41.12 37.11 1ui8 n ASP 444 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ui8 n GLY 445 N -1.05 0.86 0.03 0.44 0.00 -0.97 -4.87 105.19 99.63 1ui8 n GLY 445 Ca -0.20 -2.29 0.13 0.00 0.00 0.00 0.00 46.02 43.67 1ui8 n GLY 445 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ui8 n PHE 446 N -0.98 0.24 -2.52 1.61 3.72 -1.26 -4.22 117.46 114.05 1ui8 n PHE 446 Ca 0.00 0.07 -0.40 0.00 -0.05 0.00 0.00 57.45 57.07 1ui8 n PHE 446 Cb 0.00 -0.58 -0.03 0.00 -0.94 0.00 0.00 39.48 37.93 1ui8 n PHE 446 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1ui8 s THR 447 N -3.03 3.84 0.29 4.37 2.01 -1.26 -3.13 115.64 118.72 1ui8 s THR 447 Ca 0.13 -0.45 0.06 0.00 0.31 0.00 0.00 61.69 61.73 1ui8 s THR 447 Cb 0.17 -4.95 -0.06 0.00 0.01 0.00 0.00 72.50 67.68 1ui8 s THR 447 CO 0.57 -1.84 -0.02 0.20 -0.69 0.00 0.00 174.62 172.83 1ui8 s ASN 448 N 4.94 2.60 0.17 3.53 0.02 -0.70 -4.08 114.94 121.41 1ui8 s ASN 448 Ca 0.45 -1.24 -0.12 0.00 -1.02 0.00 0.00 52.86 50.94 1ui8 s ASN 448 Cb -0.02 -0.14 0.00 0.00 0.02 0.00 0.00 41.25 41.11 1ui8 s ASN 448 CO -0.03 -0.42 0.35 0.00 0.02 0.00 0.00 177.10 177.02 1ui8 s ARG 449 N -3.78 1.20 -0.03 -0.60 1.70 -0.54 -0.52 118.95 116.38 1ui8 s ARG 449 Ca 0.31 -1.05 0.04 0.00 -0.47 0.00 0.00 55.73 54.56 1ui8 s ARG 449 Cb 0.05 0.42 -0.01 0.00 -0.57 0.00 0.00 34.95 34.85 1ui8 s ARG 449 CO 0.12 -0.46 -0.15 0.08 -1.08 0.00 0.00 175.30 173.81 1ui8 s VAL 450 N -3.93 1.24 -0.02 4.99 1.01 -1.26 -1.40 120.40 121.03 1ui8 s VAL 450 Ca 0.13 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.54 1ui8 s VAL 450 Cb 0.02 -1.05 -0.02 0.00 0.00 0.00 0.00 36.38 35.33 1ui8 s VAL 450 CO -0.02 0.36 -0.20 -1.61 0.00 0.00 0.00 175.10 173.63 1ui8 s GLU 451 N -0.12 1.61 -0.22 2.72 2.02 -0.20 -0.73 118.70 123.78 1ui8 s GLU 451 Ca 0.01 -0.71 -0.16 0.00 0.02 0.00 0.00 54.97 54.13 1ui8 s GLU 451 Cb -0.09 -1.55 -0.04 0.00 0.10 0.00 0.00 34.13 32.55 1ui8 s GLU 451 CO 0.01 0.42 0.42 -2.00 0.02 0.00 0.00 175.26 174.13 1ui8 s GLU 452 N -0.46 4.14 -0.19 1.61 2.12 0.09 -0.58 118.70 125.43 1ui8 s GLU 452 Ca 0.07 0.21 -0.04 0.00 0.36 0.00 0.00 54.97 55.57 1ui8 s GLU 452 Cb -0.08 -3.57 -0.02 0.00 0.26 0.00 0.00 34.13 30.72 1ui8 s GLU 452 CO -0.01 -0.12 -0.02 -2.00 -0.54 0.00 0.00 175.26 172.58 1ui8 s GLU 453 N 1.56 3.58 0.06 4.30 2.12 0.22 -1.23 118.70 129.31 1ui8 s GLU 453 Ca 0.19 -0.55 0.09 0.00 0.36 0.00 0.00 54.97 55.07 1ui8 s GLU 453 Cb -0.15 -3.02 -0.03 0.00 0.26 0.00 0.00 34.13 31.19 1ui8 s GLU 453 CO 0.09 0.03 -0.25 -0.51 -0.54 0.00 0.00 175.26 174.07 1ui8 s ASP 454 N 0.93 3.30 0.32 -1.70 1.01 -0.60 -1.38 116.67 118.56 1ui8 s ASP 454 Ca 0.01 -0.60 -0.28 0.00 0.71 0.00 0.00 52.55 52.39 1ui8 s ASP 454 Cb -0.14 -0.32 -0.09 0.00 1.01 0.00 0.00 42.92 43.37 1ui8 s ASP 454 CO 0.01 0.24 1.09 -0.69 0.21 0.00 0.00 175.17 176.04 1ui8 s VAL 455 N -0.88 3.52 -0.17 -1.27 1.01 0.64 -0.90 120.40 122.35 1ui8 s VAL 455 Ca 0.13 1.40 0.01 0.00 0.00 0.00 0.00 61.98 63.52 1ui8 s VAL 455 Cb -0.10 -3.84 0.02 0.00 0.00 0.00 0.00 36.38 32.45 1ui8 s VAL 455 CO 0.04 0.24 -0.20 -0.69 0.00 0.00 0.00 175.10 174.49 1ui8 s VAL 456 N -1.32 2.14 0.25 2.92 1.01 0.02 -4.84 120.40 120.57 1ui8 s VAL 456 Ca 0.49 -0.93 -0.17 0.00 0.00 0.00 0.00 61.98 61.37 1ui8 s VAL 456 Cb -0.29 -1.89 -0.08 0.00 0.00 0.00 0.00 36.38 34.12 1ui8 s VAL 456 CO 0.37 0.54 0.71 -0.13 0.00 0.00 0.00 175.10 176.58 1ui8 s ARG 457 N 1.16 4.13 0.08 2.72 0.52 -1.26 -0.43 118.95 125.87 1ui8 s ARG 457 Ca 0.02 0.75 0.09 0.00 -0.52 0.00 0.00 55.73 56.07 1ui8 s ARG 457 Cb -0.14 -2.73 -0.04 0.00 0.52 0.00 0.00 34.95 32.57 1ui8 s ARG 457 CO -0.09 0.32 -0.22 -0.65 0.02 0.00 0.00 175.30 174.68 1ui8 s GLN 458 N -2.33 1.79 0.09 3.54 -0.21 -1.24 -4.91 119.66 116.39 1ui8 s GLN 458 Ca 0.46 -1.14 -0.21 0.00 0.02 0.00 0.00 55.36 54.49 1ui8 s GLN 458 Cb -0.14 -2.06 -0.07 0.00 1.00 0.00 0.00 33.01 31.74 1ui8 s GLN 458 CO 0.20 0.50 0.64 0.99 -2.12 0.00 0.00 175.29 175.49 1ui8 s THR 459 N -0.98 4.64 0.23 -0.19 2.01 -1.26 -4.87 115.64 115.22 1ui8 s THR 459 Ca 0.15 1.37 -0.30 0.00 0.31 0.00 0.00 61.69 63.22 1ui8 s THR 459 Cb -0.10 -3.98 -0.10 0.00 0.01 0.00 0.00 72.50 68.33 1ui8 s THR 459 CO 0.06 0.53 1.47 -0.32 -0.69 0.00 0.00 174.62 175.67 1ui8 s MET 460 N -1.03 4.25 0.00 4.92 1.75 -1.26 -4.78 119.30 123.15 1ui8 s MET 460 Ca 0.31 2.32 0.00 0.00 -1.25 0.00 0.00 55.69 57.08 1ui8 s MET 460 Cb -0.21 -3.12 0.00 0.00 2.84 0.00 0.00 34.83 34.35 1ui8 s MET 460 CO 0.21 -0.47 0.00 0.41 -0.65 0.00 0.00 175.02 174.52 1ui8 n GLY 461 N 2.57 -0.61 3.65 2.11 0.00 -0.53 -4.97 105.19 107.41 1ui8 n GLY 461 Ca 0.08 -1.04 -0.48 0.00 0.00 0.00 0.00 46.02 44.59 1ui8 n GLY 461 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ui8 n PRO 462 N 0.00 1.84 0.00 1.61 -0.02 -1.26 0.10 135.00 137.27 1ui8 n PRO 462 Ca 0.00 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 1ui8 n PRO 462 Cb 0.00 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.08 1ui8 n PRO 462 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ui8 n GLY 463 N 3.26 2.31 2.62 -1.23 0.00 -1.26 -4.78 105.19 106.11 1ui8 n GLY 463 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 1ui8 n GLY 463 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ui8 n ASN 464 N 0.00 -0.32 0.03 1.61 5.15 0.11 -4.99 115.26 116.85 1ui8 n ASN 464 Ca 0.00 -2.79 0.08 0.00 -0.60 0.00 0.00 54.58 51.27 1ui8 n ASN 464 Cb 0.00 0.33 0.50 0.00 -0.53 0.00 0.00 39.78 40.08 1ui8 n ASN 464 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 1ui8 h GLU 465 N 2.64 0.37 -0.01 1.20 3.07 -1.36 -1.12 114.58 119.37 1ui8 h GLU 465 Ca -0.14 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.70 1ui8 h GLU 465 Cb 1.18 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 29.01 1ui8 h GLU 465 CO 0.25 0.25 -0.10 0.54 -1.40 0.00 0.00 179.01 178.55 1ui8 n ARG 466 N -4.48 1.03 -3.37 2.33 1.74 -1.26 -4.62 116.66 108.04 1ui8 n ARG 466 Ca 0.04 -0.46 -0.24 0.00 -0.77 0.00 0.00 57.85 56.42 1ui8 n ARG 466 Cb 0.18 -1.49 0.06 0.00 -1.02 0.00 0.00 32.46 30.19 1ui8 n ARG 466 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ui8 n GLY 467 N 1.23 -0.54 0.00 -0.13 0.00 -0.58 -4.89 105.19 100.28 1ui8 n GLY 467 Ca 0.16 0.20 0.05 0.00 0.00 0.00 0.00 46.02 46.44 1ui8 n GLY 467 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ui8 n ASN 468 N -2.79 1.85 -4.76 1.61 6.94 -1.26 -4.87 115.26 111.97 1ui8 n ASN 468 Ca -0.04 -0.26 -0.38 0.00 -0.02 0.00 0.00 54.58 53.87 1ui8 n ASN 468 Cb 0.58 1.31 0.01 0.00 -2.36 0.00 0.00 39.78 39.32 1ui8 n ASN 468 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ui8 s ALA 469 N -2.46 3.03 -0.02 -2.53 0.00 -1.26 -5.05 121.76 113.47 1ui8 s ALA 469 Ca -0.01 1.14 -0.15 0.00 0.00 0.00 0.00 51.96 52.93 1ui8 s ALA 469 Cb 0.07 -3.47 0.03 0.00 0.00 0.00 0.00 23.12 19.75 1ui8 s ALA 469 CO 0.43 -0.90 0.33 -0.59 0.00 0.00 0.00 175.76 175.02 1ui8 s PHE 470 N -1.39 -0.21 0.00 0.00 -0.12 -1.26 -3.72 117.98 111.28 1ui8 s PHE 470 Ca 0.63 0.33 0.00 0.00 -0.05 0.00 0.00 56.93 57.85 1ui8 s PHE 470 Cb -0.35 0.11 0.00 0.00 -0.63 0.00 0.00 43.02 42.15 1ui8 s PHE 470 CO 0.43 -0.39 0.00 0.45 -0.05 0.00 0.00 175.22 175.66 1ui8 n SER 471 N 1.33 0.52 -3.74 1.98 2.88 0.42 -4.99 113.62 112.02 1ui8 n SER 471 Ca -0.21 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.21 1ui8 n SER 471 Cb 0.56 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.95 1ui8 n SER 471 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ui8 s ARG 472 N 1.18 0.79 0.03 -1.46 1.70 -1.26 -0.80 118.95 119.14 1ui8 s ARG 472 Ca 0.00 -0.41 0.03 0.00 -0.47 0.00 0.00 55.73 54.88 1ui8 s ARG 472 Cb 0.00 0.35 -0.02 0.00 -0.57 0.00 0.00 34.95 34.71 1ui8 s ARG 472 CO 0.00 -0.25 -0.09 -1.59 -1.08 0.00 0.00 175.30 172.29 1ui8 s LYS 473 N -2.26 0.60 -0.07 3.89 -2.85 -0.07 -4.81 119.74 114.18 1ui8 s LYS 473 Ca -0.07 -0.62 0.03 0.00 -1.00 0.00 0.00 55.97 54.32 1ui8 s LYS 473 Cb -0.02 -0.49 0.00 0.00 -2.06 0.00 0.00 37.83 35.27 1ui8 s LYS 473 CO -0.01 0.11 -0.17 1.03 0.10 0.00 0.00 175.35 176.41 1ui8 s ARG 474 N -1.11 2.10 -0.21 1.78 0.52 -1.26 -1.56 118.95 119.21 1ui8 s ARG 474 Ca -0.04 -0.61 0.02 0.00 -0.52 0.00 0.00 55.73 54.58 1ui8 s ARG 474 Cb -0.07 -1.70 0.04 0.00 0.52 0.00 0.00 34.95 33.73 1ui8 s ARG 474 CO 0.00 0.15 -0.16 0.99 0.02 0.00 0.00 175.30 176.30 1ui8 s THR 475 N 0.36 2.11 0.20 0.02 2.01 -0.37 -4.92 115.64 115.06 1ui8 s THR 475 Ca -0.12 -1.23 -0.30 0.00 0.31 0.00 0.00 61.69 60.35 1ui8 s THR 475 Cb -0.15 -2.04 -0.08 0.00 0.01 0.00 0.00 72.50 70.24 1ui8 s THR 475 CO 0.05 0.30 1.16 0.54 -0.69 0.00 0.00 174.62 175.98 1ui8 s VAL 476 N 1.21 3.60 -0.48 3.82 0.11 -1.26 -0.73 120.40 126.66 1ui8 s VAL 476 Ca -0.01 1.40 -0.22 0.00 -2.93 0.00 0.00 61.98 60.22 1ui8 s VAL 476 Cb -0.16 -3.89 0.04 0.00 -1.53 0.00 0.00 36.38 30.83 1ui8 s VAL 476 CO -0.10 0.25 0.74 -0.76 -3.33 0.00 0.00 175.10 171.91 1ui8 s LEU 477 N -0.51 4.46 -0.05 2.54 1.43 0.09 -4.94 118.68 121.69 1ui8 s LEU 477 Ca 0.50 -0.42 0.08 0.00 -1.03 0.00 0.00 54.13 53.27 1ui8 s LEU 477 Cb -0.32 -2.74 -0.24 0.00 0.03 0.00 0.00 46.19 42.92 1ui8 s LEU 477 CO 0.37 -0.94 0.63 0.71 0.23 0.00 0.00 176.35 177.35 1ui8 h THR 478 N 5.93 0.83 -3.62 5.49 1.35 -1.89 -3.38 112.91 117.62 1ui8 h THR 478 Ca -0.26 -2.65 -0.31 0.00 -0.55 0.00 0.00 66.41 62.64 1ui8 h THR 478 Cb 1.09 2.46 -0.16 0.00 -1.73 0.00 0.00 68.15 69.80 1ui8 h THR 478 CO 0.97 0.59 -0.72 -0.13 -0.25 0.00 0.00 175.52 175.97 1ui8 s ARG 479 N -2.59 0.93 0.52 4.72 1.81 -1.26 -1.11 118.95 121.96 1ui8 s ARG 479 Ca -0.08 -1.28 0.23 0.00 -1.72 0.00 0.00 55.73 52.87 1ui8 s ARG 479 Cb 0.08 -0.54 1.42 0.00 -0.45 0.00 0.00 34.95 35.45 1ui8 s ARG 479 CO 0.82 0.07 2.12 0.93 -0.68 0.00 0.00 175.30 178.56 1ui8 h GLU 480 N 3.22 0.00 0.00 3.54 5.08 -1.44 -1.79 114.58 123.19 1ui8 h GLU 480 Ca -0.37 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1ui8 h GLU 480 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1ui8 h GLU 480 CO 0.58 0.08 0.00 -1.13 -1.00 0.00 0.00 179.01 177.54 1ui8 n SER 481 N -4.02 0.12 -0.10 1.42 3.41 -1.26 -1.73 113.62 111.45 1ui8 n SER 481 Ca -0.03 0.54 0.05 0.00 -0.26 0.00 0.00 58.87 59.17 1ui8 n SER 481 Cb 0.17 -0.56 0.07 0.00 -0.26 0.00 0.00 64.21 63.63 1ui8 n SER 481 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1ui8 n GLU 482 N -1.64 1.50 -0.80 4.33 0.28 -0.68 -4.75 120.64 118.88 1ui8 n GLU 482 Ca 0.02 -1.87 0.02 0.00 -0.16 0.00 0.00 57.16 55.18 1ui8 n GLU 482 Cb 0.12 -1.13 0.32 0.00 1.43 0.00 0.00 31.44 32.17 1ui8 n GLU 482 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1ui8 n ALA 483 N -0.84 3.88 -3.63 -1.84 0.00 -0.71 -4.81 120.51 112.56 1ui8 n ALA 483 Ca 0.08 -2.27 -0.37 0.00 0.00 0.00 0.00 53.44 50.88 1ui8 n ALA 483 Cb 0.52 -1.01 -0.12 0.00 0.00 0.00 0.00 19.45 18.84 1ui8 n ALA 483 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1ui8 s VAL 484 N -2.90 3.41 0.20 0.00 1.01 -1.26 -1.74 120.40 119.12 1ui8 s VAL 484 Ca 0.50 -1.73 0.09 0.00 0.00 0.00 0.00 61.98 60.84 1ui8 s VAL 484 Cb 0.40 -3.18 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 1ui8 s VAL 484 CO 0.12 -0.49 -0.08 -0.13 0.00 0.00 0.00 175.10 174.51 1ui8 s ARG 485 N 1.23 2.08 0.27 2.72 1.81 0.48 -5.00 118.95 122.55 1ui8 s ARG 485 Ca 0.04 -1.31 0.10 0.00 -1.72 0.00 0.00 55.73 52.83 1ui8 s ARG 485 Cb -0.22 -2.14 -0.04 0.00 -0.45 0.00 0.00 34.95 32.09 1ui8 s ARG 485 CO -0.02 0.42 -0.03 -1.83 -0.68 0.00 0.00 175.30 173.16 1ui8 s GLU 486 N -3.00 2.19 0.70 3.54 -1.05 -1.26 -1.54 118.70 118.28 1ui8 s GLU 486 Ca 0.26 -1.49 -0.11 0.00 -0.15 0.00 0.00 54.97 53.48 1ui8 s GLU 486 Cb -0.08 -2.09 0.01 0.00 -0.44 0.00 0.00 34.13 31.53 1ui8 s GLU 486 CO 0.16 0.34 1.07 0.00 0.95 0.00 0.00 175.26 177.78 1ui8 s ALA 487 N -2.37 2.60 -0.49 -0.84 0.00 -1.26 -4.92 121.76 114.48 1ui8 s ALA 487 Ca 0.32 0.15 0.06 0.00 0.00 0.00 0.00 51.96 52.49 1ui8 s ALA 487 Cb -0.06 -3.20 0.19 0.00 0.00 0.00 0.00 23.12 20.05 1ui8 s ALA 487 CO 0.19 -1.30 0.66 -3.47 0.00 0.00 0.00 175.76 171.85 1ui8 n ASP 488 N -3.11 -2.73 -0.07 0.00 -0.08 -1.26 -5.01 116.55 104.29 1ui8 n ASP 488 Ca 0.08 -2.84 0.06 0.00 -1.51 0.00 0.00 54.79 50.58 1ui8 n ASP 488 Cb 0.53 1.24 0.41 0.00 2.34 0.00 0.00 41.12 45.65 1ui8 n ASP 488 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ui8 h ALA 489 N 5.01 1.75 -0.90 -1.67 0.00 -1.94 -1.68 119.26 119.83 1ui8 h ALA 489 Ca 0.08 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.02 1ui8 h ALA 489 Cb 1.06 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.62 1ui8 h ALA 489 CO 0.12 0.19 0.59 -0.09 0.00 0.00 0.00 179.25 180.06 1ui8 h ARG 490 N 0.60 1.02 -0.51 0.00 2.43 -1.99 -1.45 114.38 114.48 1ui8 h ARG 490 Ca 0.21 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.28 1ui8 h ARG 490 Cb 0.11 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 1ui8 h ARG 490 CO -0.06 0.67 0.04 0.25 -1.51 0.00 0.00 179.97 179.37 1ui8 n THR 491 N -4.48 2.67 -3.86 0.20 -2.24 -1.03 -4.95 114.28 100.59 1ui8 n THR 491 Ca 0.13 -1.62 -0.30 0.00 -2.27 0.00 0.00 64.05 59.99 1ui8 n THR 491 Cb 0.17 -0.29 0.01 0.00 -2.10 0.00 0.00 70.33 68.12 1ui8 n THR 491 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ui8 n GLY 492 N 0.13 -0.49 3.73 3.38 0.00 -0.55 -0.26 105.19 111.14 1ui8 n GLY 492 Ca 0.28 0.16 -0.42 0.00 0.00 0.00 0.00 46.02 46.05 1ui8 n GLY 492 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ui8 s ARG 493 N -6.56 4.18 0.24 1.61 3.52 -0.66 -4.51 118.95 116.76 1ui8 s ARG 493 Ca 0.63 2.47 0.01 0.00 -0.13 0.00 0.00 55.73 58.72 1ui8 s ARG 493 Cb -0.33 -3.10 -0.04 0.00 -1.56 0.00 0.00 34.95 29.93 1ui8 s ARG 493 CO 0.78 -0.63 0.17 0.95 -0.81 0.00 0.00 175.30 175.76 1ui8 s THR 494 N 0.74 0.00 -0.07 4.11 -4.23 -0.48 -4.75 115.64 110.97 1ui8 s THR 494 Ca 0.68 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.21 1ui8 s THR 494 Cb -0.46 -2.50 0.02 0.00 1.34 0.00 0.00 72.50 70.90 1ui8 s THR 494 CO 0.37 0.00 -0.10 0.26 -0.54 0.00 0.00 174.62 174.61 1ui8 s TRP 495 N -3.95 1.32 -0.19 3.99 0.51 -1.18 -0.61 118.94 118.83 1ui8 s TRP 495 Ca 0.40 -0.51 -0.06 0.00 -2.12 0.00 0.00 56.10 53.81 1ui8 s TRP 495 Cb 0.06 -1.02 -0.03 0.00 -0.81 0.00 0.00 33.47 31.66 1ui8 s TRP 495 CO 0.17 -0.31 0.03 0.42 -0.51 0.00 0.00 176.95 176.74 1ui8 s ILE 496 N 0.93 4.33 -0.30 2.03 1.01 0.26 -0.47 121.20 128.99 1ui8 s ILE 496 Ca -0.10 -0.19 -0.10 0.00 0.00 0.00 0.00 60.65 60.26 1ui8 s ILE 496 Cb -0.15 -2.95 -0.02 0.00 0.01 0.00 0.00 42.46 39.35 1ui8 s ILE 496 CO 0.01 0.44 0.15 -0.63 0.00 0.00 0.00 174.94 174.91 1ui8 s ILE 497 N 0.67 4.73 0.34 2.92 1.09 -0.05 -1.03 121.20 129.87 1ui8 s ILE 497 Ca 0.01 -0.26 0.05 0.00 -1.10 0.00 0.00 60.65 59.35 1ui8 s ILE 497 Cb -0.14 -3.36 -0.07 0.00 -1.06 0.00 0.00 42.46 37.84 1ui8 s ILE 497 CO 0.02 0.14 0.02 -0.94 -0.10 0.00 0.00 174.94 174.07 1ui8 s SER 498 N 1.65 2.92 -0.37 3.58 1.04 -0.50 -1.36 113.70 120.67 1ui8 s SER 498 Ca 0.05 -1.33 -0.04 0.00 0.48 0.00 0.00 55.95 55.12 1ui8 s SER 498 Cb -0.17 -0.20 0.08 0.00 0.10 0.00 0.00 66.02 65.83 1ui8 s SER 498 CO 0.07 -0.49 0.14 0.21 0.98 0.00 0.00 173.24 174.14 1ui8 s ASN 499 N -3.54 5.21 0.00 7.02 3.84 -0.59 -1.46 114.94 125.41 1ui8 s ASN 499 Ca 0.35 -1.62 0.05 0.00 0.21 0.00 0.00 52.86 51.85 1ui8 s ASN 499 Cb 0.08 -1.82 0.24 0.00 -0.55 0.00 0.00 41.25 39.19 1ui8 s ASN 499 CO 0.16 -0.43 1.17 -0.81 -2.79 0.00 0.00 177.10 174.40 1ui8 n PRO 500 N 4.67 0.00 -0.09 0.43 -0.04 -1.26 -2.15 135.00 136.57 1ui8 n PRO 500 Ca -0.08 0.40 0.06 0.00 -0.04 0.00 0.00 63.50 63.84 1ui8 n PRO 500 Cb 0.43 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.49 1ui8 n PRO 500 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1ui8 n GLU 501 N -1.49 1.75 -3.91 0.54 1.02 -1.26 -4.87 120.64 112.41 1ui8 n GLU 501 Ca 0.01 -1.65 -0.28 0.00 -0.02 0.00 0.00 57.16 55.22 1ui8 n GLU 501 Cb 0.06 -1.26 -0.16 0.00 -0.02 0.00 0.00 31.44 30.06 1ui8 n GLU 501 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1ui8 s SER 502 N -1.01 2.82 0.08 1.62 0.15 -0.91 -5.10 113.70 111.36 1ui8 s SER 502 Ca 0.20 -0.64 0.07 0.00 0.70 0.00 0.00 55.95 56.28 1ui8 s SER 502 Cb 0.12 -0.96 -0.04 0.00 -1.71 0.00 0.00 66.02 63.43 1ui8 s SER 502 CO 0.16 -0.17 -0.13 -0.54 1.20 0.00 0.00 173.24 173.76 1ui8 s LYS 503 N 1.61 2.08 0.76 5.44 1.02 -1.26 -0.76 119.74 128.62 1ui8 s LYS 503 Ca 0.01 -1.02 -0.12 0.00 0.02 0.00 0.00 55.97 54.86 1ui8 s LYS 503 Cb -0.15 -2.25 0.17 0.00 -0.52 0.00 0.00 37.83 35.08 1ui8 s LYS 503 CO -0.08 0.52 1.04 0.27 -0.92 0.00 0.00 175.35 176.17 1ui8 n ASN 504 N 0.99 0.22 0.27 2.83 0.23 0.13 -4.83 115.26 115.09 1ui8 n ASN 504 Ca -0.15 -1.46 0.18 0.00 -0.53 0.00 0.00 54.58 52.63 1ui8 n ASN 504 Cb 0.52 -0.78 0.95 0.00 -2.08 0.00 0.00 39.78 38.39 1ui8 n ASN 504 CO 0.00 0.00 0.00 0.08 -0.93 0.00 0.00 177.26 176.41 1ui8 h ARG 505 N 0.00 0.00 -0.61 -3.83 0.11 -1.89 0.18 114.38 108.34 1ui8 h ARG 505 Ca -0.34 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.74 1ui8 h ARG 505 Cb 0.96 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.04 1ui8 h ARG 505 CO 0.25 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.60 1ui8 n LEU 506 N -2.76 3.56 -3.45 0.08 4.77 -1.26 -4.92 117.00 113.02 1ui8 n LEU 506 Ca -0.02 -1.79 -0.21 0.00 -0.03 0.00 0.00 56.01 53.96 1ui8 n LEU 506 Cb 0.08 -0.46 0.08 0.00 -2.33 0.00 0.00 43.42 40.79 1ui8 n LEU 506 CO 0.17 0.74 0.20 -3.20 -1.33 0.00 0.00 177.39 173.97 1ui8 n ASN 507 N 1.07 -5.08 -4.25 -1.43 4.05 0.63 -5.03 115.26 105.22 1ui8 n ASN 507 Ca 0.20 -0.54 -0.30 0.00 0.45 0.00 0.00 54.58 54.39 1ui8 n ASN 507 Cb 0.62 -4.90 -0.16 0.00 1.23 0.00 0.00 39.78 36.57 1ui8 n ASN 507 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 1ui8 s GLU 508 N -6.01 2.30 0.10 1.20 0.41 -1.25 -4.85 118.70 110.60 1ui8 s GLU 508 Ca 0.41 -0.84 -0.35 0.00 -0.41 0.00 0.00 54.97 53.77 1ui8 s GLU 508 Cb -0.18 -2.00 -0.15 0.00 -1.78 0.00 0.00 34.13 30.02 1ui8 s GLU 508 CO 0.70 0.38 1.49 -2.30 -0.49 0.00 0.00 175.26 175.05 1ui8 n PRO 509 N 2.89 1.67 -2.03 0.39 -0.02 -1.26 -0.69 135.00 135.95 1ui8 n PRO 509 Ca -0.17 0.60 -0.36 0.00 -2.02 0.00 0.00 63.50 61.55 1ui8 n PRO 509 Cb 0.52 -2.32 0.03 0.00 -0.02 0.00 0.00 33.50 31.71 1ui8 n PRO 509 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1ui8 s VAL 510 N 0.96 2.65 0.35 -1.45 -7.23 0.06 -4.80 120.40 110.93 1ui8 s VAL 510 Ca 0.83 0.42 -0.18 0.00 -1.81 0.00 0.00 61.98 61.24 1ui8 s VAL 510 Cb -0.82 -3.18 0.04 0.00 0.56 0.00 0.00 36.38 32.98 1ui8 s VAL 510 CO 0.43 -0.07 0.77 -0.83 -0.31 0.00 0.00 175.10 175.10 1ui8 s GLY 511 N -1.49 0.21 0.00 2.32 0.00 -1.04 -1.54 107.32 105.78 1ui8 s GLY 511 Ca 0.75 -0.59 0.00 0.00 0.00 0.00 0.00 44.72 44.88 1ui8 s GLY 511 CO 0.35 -0.19 -0.02 -0.19 0.00 0.00 0.00 173.10 173.05 1ui8 s TYR 512 N -2.85 0.16 -0.17 1.90 1.51 -0.46 -0.75 117.35 116.69 1ui8 s TYR 512 Ca 0.14 -0.10 -0.03 0.00 -1.01 0.00 0.00 57.07 56.07 1ui8 s TYR 512 Cb -0.05 -0.10 -0.02 0.00 -0.11 0.00 0.00 41.96 41.67 1ui8 s TYR 512 CO 0.10 -0.03 -0.06 0.21 -1.11 0.00 0.00 175.55 174.66 1ui8 s LYS 513 N -0.25 3.53 -0.25 -0.62 2.20 0.11 -0.87 119.74 123.58 1ui8 s LYS 513 Ca -0.02 -0.59 -0.19 0.00 -0.36 0.00 0.00 55.97 54.81 1ui8 s LYS 513 Cb -0.02 -2.89 -0.02 0.00 -1.51 0.00 0.00 37.83 33.39 1ui8 s LYS 513 CO -0.00 0.11 0.59 -1.17 -0.36 0.00 0.00 175.35 174.51 1ui8 s LEU 514 N 0.69 4.06 -0.32 5.43 2.96 0.38 -0.59 118.68 131.29 1ui8 s LEU 514 Ca -0.03 0.65 -0.09 0.00 -0.22 0.00 0.00 54.13 54.44 1ui8 s LEU 514 Cb -0.15 -2.79 0.01 0.00 0.50 0.00 0.00 46.19 43.76 1ui8 s LEU 514 CO 0.02 -0.33 0.14 -1.00 -1.32 0.00 0.00 176.35 173.86 1ui8 s HIS 515 N 2.38 3.19 0.40 5.38 3.76 0.07 -3.08 115.29 127.40 1ui8 s HIS 515 Ca 0.25 -0.85 0.00 0.00 -0.15 0.00 0.00 55.06 54.31 1ui8 s HIS 515 Cb -0.16 -2.34 -0.02 0.00 1.11 0.00 0.00 32.58 31.17 1ui8 s HIS 515 CO 0.09 -0.56 0.62 0.00 -0.85 0.00 0.00 174.74 174.04 1ui8 s ALA 516 N 1.55 3.71 -0.83 -1.40 0.00 -1.26 -2.41 121.76 121.12 1ui8 s ALA 516 Ca 0.03 -0.95 0.26 0.00 0.00 0.00 0.00 51.96 51.30 1ui8 s ALA 516 Cb -0.18 -2.15 0.68 0.00 0.00 0.00 0.00 23.12 21.48 1ui8 s ALA 516 CO 0.05 -0.20 1.58 0.72 0.00 0.00 0.00 175.76 177.91 1ui8 n HIS 517 N -1.94 0.37 -3.54 0.00 8.25 -1.26 -4.96 115.22 112.14 1ui8 n HIS 517 Ca -0.02 0.11 -0.22 0.00 -0.26 0.00 0.00 57.72 57.32 1ui8 n HIS 517 Cb 0.57 -0.58 0.08 0.00 1.12 0.00 0.00 29.99 31.18 1ui8 n HIS 517 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1ui8 n ASN 518 N -1.85 -5.89 -4.87 0.41 3.02 -1.26 -5.01 115.26 99.81 1ui8 n ASN 518 Ca 0.05 -0.53 -0.31 0.00 -0.03 0.00 0.00 54.58 53.77 1ui8 n ASN 518 Cb 0.39 -4.87 0.02 0.00 -0.61 0.00 0.00 39.78 34.70 1ui8 n ASN 518 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1ui8 s GLN 519 N -6.19 3.48 0.52 3.52 -1.52 -1.26 -4.99 119.66 113.23 1ui8 s GLN 519 Ca 0.52 0.68 -0.23 0.00 -1.95 0.00 0.00 55.36 54.38 1ui8 s GLN 519 Cb -0.23 -2.08 -0.06 0.00 -0.22 0.00 0.00 33.01 30.42 1ui8 s GLN 519 CO 0.70 -0.63 1.39 -2.30 -0.25 0.00 0.00 175.29 174.21 1ui8 n PRO 520 N -2.77 1.87 -0.32 2.91 -0.02 -1.26 -4.85 135.00 130.56 1ui8 n PRO 520 Ca 0.06 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1ui8 n PRO 520 Cb 0.55 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 1ui8 n PRO 520 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1ui8 n THR 521 N -0.81 0.00 -1.68 3.45 -2.24 -1.26 -4.57 114.28 107.17 1ui8 n THR 521 Ca 0.09 0.00 -0.48 0.00 -2.27 0.00 0.00 64.05 61.39 1ui8 n THR 521 Cb 0.44 -1.35 -0.05 0.00 -2.10 0.00 0.00 70.33 67.27 1ui8 n THR 521 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1ui8 n LEU 522 N 0.00 3.28 0.09 3.22 7.94 0.44 -4.89 117.00 127.08 1ui8 n LEU 522 Ca 0.00 1.01 0.01 0.00 -1.11 0.00 0.00 56.01 55.92 1ui8 n LEU 522 Cb 0.00 -1.37 -0.02 0.00 0.53 0.00 0.00 43.42 42.56 1ui8 n LEU 522 CO 0.00 -0.15 0.15 -0.07 -1.11 0.00 0.00 177.39 176.21 1ui8 h LEU 523 N 8.28 0.00 -9.48 -1.96 3.38 -1.93 -3.46 115.31 110.14 1ui8 h LEU 523 Ca -0.48 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 56.91 1ui8 h LEU 523 Cb 1.27 0.00 0.16 0.00 0.09 0.00 0.00 40.66 42.18 1ui8 h LEU 523 CO 0.93 0.54 -0.36 0.00 0.09 0.00 0.00 178.44 179.64 1ui8 n ALA 524 N -2.30 -1.12 -1.69 1.53 0.00 -1.26 -4.86 120.51 110.82 1ui8 n ALA 524 Ca -0.03 0.03 -0.43 0.00 0.00 0.00 0.00 53.44 53.02 1ui8 n ALA 524 Cb 0.78 -1.83 -0.01 0.00 0.00 0.00 0.00 19.45 18.39 1ui8 n ALA 524 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1ui8 n ASP 525 N 0.66 2.62 0.32 0.00 -0.08 -1.26 -4.84 116.55 113.96 1ui8 n ASP 525 Ca 0.11 1.20 0.20 0.00 -1.51 0.00 0.00 54.79 54.79 1ui8 n ASP 525 Cb 0.45 -1.46 1.06 0.00 2.34 0.00 0.00 41.12 43.52 1ui8 n ASP 525 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1ui8 h PRO 526 N 2.64 0.00 -0.23 -0.67 0.13 -1.96 -1.53 132.00 130.37 1ui8 h PRO 526 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1ui8 h PRO 526 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1ui8 h PRO 526 CO 0.63 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.81 1ui8 n GLY 527 N -1.17 0.97 3.80 1.56 0.00 -1.26 -4.66 105.19 104.43 1ui8 n GLY 527 Ca -0.02 -0.59 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 1ui8 n GLY 527 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ui8 s SER 528 N -1.62 4.69 0.12 1.61 1.04 -0.58 -4.95 113.70 114.02 1ui8 s SER 528 Ca 0.35 1.46 -0.17 0.00 0.48 0.00 0.00 55.95 58.07 1ui8 s SER 528 Cb 0.20 -2.23 -0.03 0.00 0.10 0.00 0.00 66.02 64.07 1ui8 s SER 528 CO 0.29 -1.86 1.65 -1.28 0.98 0.00 0.00 173.24 173.02 1ui8 h SER 529 N -1.01 0.50 -0.15 7.02 0.87 -1.90 -2.74 113.55 116.14 1ui8 h SER 529 Ca -0.46 -0.19 -0.02 0.00 -1.23 0.00 0.00 61.79 59.89 1ui8 h SER 529 Cb 1.25 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 63.07 1ui8 h SER 529 CO 0.58 0.56 0.04 -0.29 -0.53 0.00 0.00 176.83 177.18 1ui8 h ILE 530 N 0.41 1.12 -0.22 2.23 6.09 -1.93 0.65 117.51 125.86 1ui8 h ILE 530 Ca 0.11 -0.41 -0.09 0.00 -1.37 0.00 0.00 64.86 63.10 1ui8 h ILE 530 Cb 0.23 0.90 -0.01 0.00 0.47 0.00 0.00 36.82 38.41 1ui8 h ILE 530 CO -0.01 0.15 -0.25 0.00 -3.07 0.00 0.00 178.15 174.97 1ui8 h ALA 531 N 1.74 1.17 -0.00 0.18 0.00 -1.74 0.24 119.26 120.85 1ui8 h ALA 531 Ca 0.08 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 1ui8 h ALA 531 Cb 0.14 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.83 1ui8 h ALA 531 CO -0.00 0.53 -0.49 0.00 0.00 0.00 0.00 179.25 179.29 1ui8 h ARG 532 N 0.37 0.34 -0.01 0.00 3.08 -0.97 -2.33 114.38 114.85 1ui8 h ARG 532 Ca 0.06 -0.36 -0.15 0.00 0.07 0.00 0.00 59.98 59.59 1ui8 h ARG 532 Cb 0.63 0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.77 1ui8 h ARG 532 CO 0.05 1.05 -0.70 0.00 -1.07 0.00 0.00 179.97 179.30 1ui8 h ARG 533 N -0.22 0.06 -1.28 0.04 3.08 -0.80 -1.58 114.38 113.68 1ui8 h ARG 533 Ca -0.06 -0.05 -0.58 0.00 0.07 0.00 0.00 59.98 59.35 1ui8 h ARG 533 Cb 1.22 0.01 -0.42 0.00 0.08 0.00 0.00 29.97 30.86 1ui8 h ARG 533 CO 0.10 0.73 -0.69 0.00 -1.07 0.00 0.00 179.97 179.04 1ui8 n ALA 534 N -2.43 5.11 0.16 0.04 0.00 0.82 -4.83 120.51 119.39 1ui8 n ALA 534 Ca -0.02 -4.14 0.15 0.00 0.00 0.00 0.00 53.44 49.43 1ui8 n ALA 534 Cb 0.68 -0.53 0.72 0.00 0.00 0.00 0.00 19.45 20.32 1ui8 n ALA 534 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ui8 h ALA 535 N 2.46 2.10 -0.56 0.00 0.00 -1.48 -0.93 119.26 120.84 1ui8 h ALA 535 Ca 0.33 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.32 1ui8 h ALA 535 Cb 1.09 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1ui8 h ALA 535 CO 0.85 -0.29 0.38 0.27 0.00 0.00 0.00 179.25 180.46 1ui8 h PHE 536 N 0.00 0.43 0.00 0.00 -0.00 -1.86 -2.02 116.94 113.49 1ui8 h PHE 536 Ca 0.10 0.01 0.00 0.00 -0.00 0.00 0.00 57.97 58.09 1ui8 h PHE 536 Cb 0.45 -0.14 0.00 0.00 -0.00 0.00 0.00 35.95 36.26 1ui8 h PHE 536 CO 0.00 0.22 0.00 0.00 -0.00 0.00 0.00 178.31 178.53 1ui8 n ALA 537 N -2.52 2.01 0.67 12.09 0.00 -0.35 -3.10 120.51 129.31 1ui8 n ALA 537 Ca 0.09 -0.08 0.13 0.00 0.00 0.00 0.00 53.44 53.57 1ui8 n ALA 537 Cb 0.33 -1.34 0.30 0.00 0.00 0.00 0.00 19.45 18.74 1ui8 n ALA 537 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ui8 n THR 538 N -1.44 0.38 -4.17 0.00 -2.24 -0.76 -0.42 114.28 105.62 1ui8 n THR 538 Ca 0.06 -0.23 -0.17 0.00 -2.27 0.00 0.00 64.05 61.44 1ui8 n THR 538 Cb 0.23 -0.29 -0.12 0.00 -2.10 0.00 0.00 70.33 68.05 1ui8 n THR 538 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1ui8 s LYS 539 N -3.11 0.77 0.16 -0.78 -0.14 -1.18 -4.71 119.74 110.75 1ui8 s LYS 539 Ca 0.09 -0.88 0.00 0.00 -1.36 0.00 0.00 55.97 53.83 1ui8 s LYS 539 Cb 0.14 -0.73 0.01 0.00 -1.68 0.00 0.00 37.83 35.56 1ui8 s LYS 539 CO 0.66 0.16 1.39 -0.44 -0.76 0.00 0.00 175.35 176.36 1ui8 h ASP 540 N 4.45 0.36 -3.49 2.83 5.19 -1.69 -3.39 116.42 120.68 1ui8 h ASP 540 Ca -0.39 -0.27 -0.19 0.00 -0.62 0.00 0.00 57.03 55.55 1ui8 h ASP 540 Cb 1.19 -0.11 -0.29 0.00 0.18 0.00 0.00 39.33 40.30 1ui8 h ASP 540 CO 0.41 1.05 -0.49 -0.22 -3.12 0.00 0.00 179.24 176.87 1ui8 s LEU 541 N -7.63 0.66 0.03 1.55 2.96 -0.59 -1.08 118.68 114.58 1ui8 s LEU 541 Ca -0.04 0.47 0.07 0.00 -0.22 0.00 0.00 54.13 54.41 1ui8 s LEU 541 Cb 0.10 0.69 -0.02 0.00 0.50 0.00 0.00 46.19 47.46 1ui8 s LEU 541 CO 0.84 -0.14 -0.20 0.26 -1.32 0.00 0.00 176.35 175.79 1ui8 s TRP 542 N 0.93 1.77 -0.10 5.38 0.52 -0.39 -0.39 118.94 126.67 1ui8 s TRP 542 Ca -0.07 -0.37 0.01 0.00 0.02 0.00 0.00 56.10 55.69 1ui8 s TRP 542 Cb -0.08 -1.07 0.02 0.00 -1.15 0.00 0.00 33.47 31.19 1ui8 s TRP 542 CO -0.06 0.07 -0.11 0.08 0.02 0.00 0.00 176.95 176.95 1ui8 s VAL 543 N -0.74 1.17 0.25 4.03 1.01 -0.71 -0.48 120.40 124.94 1ui8 s VAL 543 Ca 0.07 -0.42 0.07 0.00 0.00 0.00 0.00 61.98 61.70 1ui8 s VAL 543 Cb -0.09 -1.13 -0.05 0.00 0.00 0.00 0.00 36.38 35.11 1ui8 s VAL 543 CO 0.01 0.38 -0.10 0.42 0.00 0.00 0.00 175.10 175.81 1ui8 s THR 544 N 1.29 1.75 0.10 3.92 -4.23 -0.47 -4.71 115.64 113.29 1ui8 s THR 544 Ca -0.02 -2.18 -0.28 0.00 -1.18 0.00 0.00 61.69 58.03 1ui8 s THR 544 Cb -0.14 -2.30 -0.06 0.00 1.34 0.00 0.00 72.50 71.35 1ui8 s THR 544 CO -0.04 -0.41 0.87 -0.60 -0.54 0.00 0.00 174.62 173.89 1ui8 s ARG 545 N -3.68 4.62 0.53 3.99 6.06 -1.26 -0.89 118.95 128.31 1ui8 s ARG 545 Ca 0.27 1.28 -0.22 0.00 -2.50 0.00 0.00 55.73 54.55 1ui8 s ARG 545 Cb 0.01 -3.36 -0.05 0.00 0.06 0.00 0.00 34.95 31.61 1ui8 s ARG 545 CO 0.10 0.29 1.36 -0.47 -2.50 0.00 0.00 175.30 174.09 1ui8 s TYR 546 N -0.18 2.31 -0.27 5.12 6.14 -0.15 -4.82 117.35 125.50 1ui8 s TYR 546 Ca 0.42 1.36 -0.15 0.00 0.64 0.00 0.00 57.07 59.34 1ui8 s TYR 546 Cb -0.22 -3.81 0.08 0.00 0.42 0.00 0.00 41.96 38.42 1ui8 s TYR 546 CO 0.27 -2.90 0.66 0.00 0.64 0.00 0.00 175.55 174.22 1ui8 s ALA 547 N -1.29 -1.78 -0.16 3.97 0.00 -1.26 -5.01 121.76 116.22 1ui8 s ALA 547 Ca 0.70 2.31 0.23 0.00 0.00 0.00 0.00 51.96 55.21 1ui8 s ALA 547 Cb -0.41 -1.36 1.24 0.00 0.00 0.00 0.00 23.12 22.59 1ui8 s ALA 547 CO 0.49 -0.37 1.71 0.38 0.00 0.00 0.00 175.76 177.97 1ui8 h ASP 548 N 6.97 0.00 -0.31 0.00 3.04 -2.04 -2.48 116.42 121.60 1ui8 h ASP 548 Ca -0.31 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.48 1ui8 h ASP 548 Cb 1.22 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.51 1ui8 h ASP 548 CO 0.17 0.00 0.00 -0.90 -2.04 0.00 0.00 179.24 176.47 1ui8 n ASP 549 N -2.31 3.27 -4.21 4.15 3.85 -1.26 -4.63 116.55 115.41 1ui8 n ASP 549 Ca -0.01 -1.96 -0.40 0.00 -0.71 0.00 0.00 54.79 51.71 1ui8 n ASP 549 Cb 0.05 -0.19 -0.04 0.00 -1.35 0.00 0.00 41.12 39.59 1ui8 n ASP 549 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 1ui8 s GLU 550 N -1.50 3.58 -0.19 0.11 2.02 -0.94 -4.83 118.70 116.96 1ui8 s GLU 550 Ca 0.34 -3.14 0.11 0.00 0.02 0.00 0.00 54.97 52.30 1ui8 s GLU 550 Cb 0.21 -4.19 -0.23 0.00 0.10 0.00 0.00 34.13 30.02 1ui8 s GLU 550 CO 0.29 -1.25 0.10 0.54 0.02 0.00 0.00 175.26 174.96 1ui8 n ARG 551 N 2.67 0.68 -4.58 1.61 1.74 -1.26 -4.81 116.66 112.70 1ui8 n ARG 551 Ca 0.21 0.10 -0.23 0.00 -0.77 0.00 0.00 57.85 57.15 1ui8 n ARG 551 Cb 0.39 -1.57 -0.14 0.00 -1.02 0.00 0.00 32.46 30.11 1ui8 n ARG 551 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1ui8 s TYR 552 N -2.52 1.49 -0.07 -1.55 2.02 -1.26 -4.94 117.35 110.53 1ui8 s TYR 552 Ca -0.17 -0.33 0.29 0.00 -0.37 0.00 0.00 57.07 56.49 1ui8 s TYR 552 Cb 0.07 -0.91 1.39 0.00 -0.40 0.00 0.00 41.96 42.11 1ui8 s TYR 552 CO 0.76 0.04 1.87 -1.00 -1.57 0.00 0.00 175.55 175.65 1ui8 h PRO 553 N 5.16 0.00 -0.16 -1.71 0.13 -1.95 -2.13 132.00 131.34 1ui8 h PRO 553 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1ui8 h PRO 553 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1ui8 h PRO 553 CO 0.45 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.47 1ui8 n THR 554 N -2.55 0.60 0.00 1.56 -2.24 -1.26 -0.79 114.28 109.60 1ui8 n THR 554 Ca -0.00 -0.80 0.00 0.00 -2.27 0.00 0.00 64.05 60.98 1ui8 n THR 554 Cb 0.14 0.77 0.00 0.00 -2.10 0.00 0.00 70.33 69.14 1ui8 n THR 554 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ui8 n GLY 555 N 0.34 -0.21 0.13 3.38 0.00 -0.80 -4.30 105.19 103.73 1ui8 n GLY 555 Ca 0.07 -1.82 -0.11 0.00 0.00 0.00 0.00 46.02 44.16 1ui8 n GLY 555 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ui8 h ASP 556 N 0.00 0.34 -4.12 1.61 3.32 -1.92 -3.41 116.42 112.24 1ui8 h ASP 556 Ca 0.00 -0.29 -0.63 0.00 0.02 0.00 0.00 57.03 56.12 1ui8 h ASP 556 Cb 0.00 -0.10 -0.41 0.00 0.22 0.00 0.00 39.33 39.04 1ui8 h ASP 556 CO 0.00 1.12 -0.65 -0.36 -1.72 0.00 0.00 179.24 177.64 1ui8 s PHE 557 N -3.09 2.97 0.08 4.55 0.08 -1.26 -4.97 117.98 116.34 1ui8 s PHE 557 Ca -0.04 -3.05 -0.15 0.00 0.12 0.00 0.00 56.93 53.82 1ui8 s PHE 557 Cb 0.09 -2.63 -0.15 0.00 -0.57 0.00 0.00 43.02 39.76 1ui8 s PHE 557 CO 0.85 -0.74 1.30 0.28 -0.10 0.00 0.00 175.22 176.81 1ui8 h VAL 558 N 5.37 1.31 -1.52 -0.44 2.07 -1.79 -3.40 116.25 117.86 1ui8 h VAL 558 Ca -0.05 -1.83 -0.72 0.00 0.82 0.00 0.00 66.70 64.92 1ui8 h VAL 558 Cb 0.89 1.99 0.01 0.00 -1.52 0.00 0.00 31.29 32.66 1ui8 h VAL 558 CO 0.65 0.57 1.00 -3.20 0.02 0.00 0.00 177.57 176.61 1ui8 n ASN 559 N -4.10 2.46 -2.29 0.57 5.15 -1.25 -1.51 115.26 114.29 1ui8 n ASN 559 Ca -0.07 0.98 -0.14 0.00 -0.60 0.00 0.00 54.58 54.75 1ui8 n ASN 559 Cb 0.65 -1.17 -0.01 0.00 -0.53 0.00 0.00 39.78 38.71 1ui8 n ASN 559 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ui8 n GLN 560 N 5.92 -2.00 -2.98 1.20 6.02 -1.26 -0.53 117.38 123.75 1ui8 n GLN 560 Ca 0.28 0.71 -0.40 0.00 -0.01 0.00 0.00 57.00 57.59 1ui8 n GLN 560 Cb 0.15 -5.27 -0.05 0.00 1.02 0.00 0.00 30.24 26.09 1ui8 n GLN 560 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1ui8 s HIS 561 N -2.64 3.79 0.46 1.08 2.46 -0.57 -4.62 115.29 115.25 1ui8 s HIS 561 Ca 0.00 1.53 0.22 0.00 0.47 0.00 0.00 55.06 57.28 1ui8 s HIS 561 Cb 0.00 -2.81 1.31 0.00 -0.13 0.00 0.00 32.58 30.95 1ui8 s HIS 561 CO 0.00 0.34 2.07 0.66 -2.47 0.00 0.00 174.74 175.34 1ui8 h SER 562 N 5.27 0.00 -4.29 9.88 4.64 -1.90 -3.43 113.55 123.72 1ui8 h SER 562 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1ui8 h SER 562 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1ui8 h SER 562 CO 0.69 0.12 0.00 0.61 -0.87 0.00 0.00 176.83 177.39 1ui8 n GLY 563 N -0.97 4.09 2.08 -0.77 0.00 -1.26 -4.67 105.19 103.69 1ui8 n GLY 563 Ca -0.02 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.37 1ui8 n GLY 563 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ui8 n GLY 564 N -1.71 1.76 3.82 -0.02 0.00 -0.59 -4.92 105.19 103.53 1ui8 n GLY 564 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1ui8 n GLY 564 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ui8 s ALA 565 N -2.87 2.60 0.00 4.61 0.00 -1.26 -3.55 121.76 121.29 1ui8 s ALA 565 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.01 1ui8 s ALA 565 Cb 0.00 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.95 1ui8 s ALA 565 CO 0.00 -1.31 0.00 0.41 0.00 0.00 0.00 175.76 174.86 1ui8 n GLY 566 N -1.97 0.46 0.37 0.00 0.00 -1.26 -4.39 105.19 98.40 1ui8 n GLY 566 Ca 0.07 -0.85 -0.02 0.00 0.00 0.00 0.00 46.02 45.23 1ui8 n GLY 566 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ui8 h LEU 567 N 0.00 -1.28 -2.08 0.99 3.38 -1.18 0.65 115.31 115.79 1ui8 h LEU 567 Ca 0.00 0.28 0.03 0.00 0.09 0.00 0.00 57.88 58.28 1ui8 h LEU 567 Cb 0.00 0.68 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 1ui8 h LEU 567 CO 0.00 -0.29 0.08 1.55 0.09 0.00 0.00 178.44 179.86 1ui8 h PRO 568 N -0.06 0.00 0.12 1.13 0.13 -1.79 -1.39 132.00 130.15 1ui8 h PRO 568 Ca 0.32 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 65.16 1ui8 h PRO 568 Cb 0.59 0.00 0.03 0.00 0.13 0.00 0.00 31.00 31.75 1ui8 h PRO 568 CO -0.88 0.00 -1.19 1.03 -0.23 0.00 0.00 178.00 176.73 1ui8 h SER 569 N 0.00 0.84 0.30 1.44 0.87 -0.95 -2.93 113.55 113.13 1ui8 h SER 569 Ca 0.05 -0.83 -0.01 0.00 -1.23 0.00 0.00 61.79 59.76 1ui8 h SER 569 Cb 0.20 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 61.89 1ui8 h SER 569 CO -0.00 1.59 -0.14 1.88 -0.53 0.00 0.00 176.83 179.62 1ui8 h TYR 570 N 0.22 -0.37 0.00 2.24 0.05 -0.73 -2.86 116.97 115.53 1ui8 h TYR 570 Ca -0.18 -0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.57 1ui8 h TYR 570 Cb 1.87 0.12 -0.00 0.00 1.01 0.00 0.00 36.73 39.73 1ui8 h TYR 570 CO 0.12 -0.16 -0.07 -0.84 -1.05 0.00 0.00 178.16 176.16 1ui8 h ILE 571 N -0.50 0.28 0.00 -2.88 -0.00 -1.40 -1.78 117.51 111.24 1ui8 h ILE 571 Ca -0.04 -0.51 0.00 0.00 -0.00 0.00 0.00 64.86 64.31 1ui8 h ILE 571 Cb 0.37 1.39 0.00 0.00 -0.00 0.00 0.00 36.82 38.58 1ui8 h ILE 571 CO 0.07 0.07 0.00 0.00 -0.00 0.00 0.00 178.15 178.29 1ui8 h ALA 572 N 1.93 1.00 0.00 0.16 0.00 -1.30 0.10 119.26 121.15 1ui8 h ALA 572 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1ui8 h ALA 572 Cb 0.38 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1ui8 h ALA 572 CO 0.01 0.00 -0.12 1.96 0.00 0.00 0.00 179.25 181.10 1ui8 h GLN 573 N 0.00 0.00 -6.19 0.00 4.20 -1.41 -3.47 115.11 108.24 1ui8 h GLN 573 Ca 0.00 0.00 -0.44 0.00 0.06 0.00 0.00 58.65 58.27 1ui8 h GLN 573 Cb 0.10 0.00 0.03 0.00 0.30 0.00 0.00 27.48 27.91 1ui8 h GLN 573 CO 0.00 0.12 -0.85 -3.47 -0.67 0.00 0.00 178.83 173.96 1ui8 n ASP 574 N -3.28 -1.24 -4.89 1.46 4.64 0.35 -4.96 116.55 108.64 1ui8 n ASP 574 Ca 0.00 -0.88 -0.30 0.00 -1.38 0.00 0.00 54.79 52.23 1ui8 n ASP 574 Cb 0.37 -3.77 0.05 0.00 -1.04 0.00 0.00 41.12 36.73 1ui8 n ASP 574 CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 1ui8 s ARG 575 N -6.10 2.76 -0.13 -0.67 0.52 -1.26 -4.49 118.95 109.57 1ui8 s ARG 575 Ca 0.03 0.42 -0.29 0.00 -0.52 0.00 0.00 55.73 55.37 1ui8 s ARG 575 Cb -0.01 -2.01 -0.01 0.00 0.52 0.00 0.00 34.95 33.43 1ui8 s ARG 575 CO 0.83 -1.10 1.14 0.34 0.02 0.00 0.00 175.30 176.54 1ui8 s ASP 576 N -4.38 7.08 0.00 0.23 2.15 -1.26 -1.35 116.67 119.13 1ui8 s ASP 576 Ca 0.59 1.62 0.01 0.00 0.43 0.00 0.00 52.55 55.20 1ui8 s ASP 576 Cb -0.11 -2.55 0.02 0.00 -0.30 0.00 0.00 42.92 39.98 1ui8 s ASP 576 CO 0.51 -0.62 0.89 2.30 -0.17 0.00 0.00 175.17 178.08 1ui8 n ILE 577 N 4.95 0.72 -2.84 4.11 -5.35 -0.27 -4.79 119.36 115.90 1ui8 n ILE 577 Ca 0.11 -0.86 -0.43 0.00 -0.27 0.00 0.00 62.75 61.30 1ui8 n ILE 577 Cb 0.46 0.65 -0.03 0.00 -1.74 0.00 0.00 39.64 38.98 1ui8 n ILE 577 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1ui8 s ASP 578 N -0.74 6.60 0.00 7.28 -1.08 -1.15 -3.93 116.67 123.64 1ui8 s ASP 578 Ca 0.02 -1.91 0.00 0.00 -0.52 0.00 0.00 52.55 50.14 1ui8 s ASP 578 Cb 0.01 -2.44 0.00 0.00 -1.46 0.00 0.00 42.92 39.03 1ui8 s ASP 578 CO 0.01 -1.17 0.00 0.61 0.52 0.00 0.00 175.17 175.15 1ui8 n GLY 579 N 5.82 0.49 3.31 2.66 0.00 0.32 -4.98 105.19 112.81 1ui8 n GLY 579 Ca 0.26 -0.41 -0.19 0.00 0.00 0.00 0.00 46.02 45.68 1ui8 n GLY 579 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ui8 s GLN 580 N -3.32 1.70 -0.52 1.61 -1.52 -0.05 -4.56 119.66 113.00 1ui8 s GLN 580 Ca 0.00 -1.99 -0.28 0.00 -1.95 0.00 0.00 55.36 51.14 1ui8 s GLN 580 Cb 0.00 0.15 0.02 0.00 -0.22 0.00 0.00 33.01 32.96 1ui8 s GLN 580 CO 0.00 -0.58 1.32 0.34 -0.25 0.00 0.00 175.29 176.12 1ui8 s ASP 581 N -3.38 6.32 0.33 5.90 -1.08 -1.18 -1.72 116.67 121.86 1ui8 s ASP 581 Ca 0.38 0.38 0.08 0.00 -0.52 0.00 0.00 52.55 52.87 1ui8 s ASP 581 Cb 0.03 -2.55 -0.06 0.00 -1.46 0.00 0.00 42.92 38.88 1ui8 s ASP 581 CO 0.23 -1.53 -0.06 0.27 0.52 0.00 0.00 175.17 174.59 1ui8 s ILE 582 N 5.44 1.97 -0.04 4.11 -4.36 -1.26 -0.98 121.20 126.08 1ui8 s ILE 582 Ca 0.51 -2.15 0.02 0.00 -0.26 0.00 0.00 60.65 58.77 1ui8 s ILE 582 Cb -0.10 -2.63 0.01 0.00 1.25 0.00 0.00 42.46 40.99 1ui8 s ILE 582 CO 0.28 -0.20 -0.08 -0.69 0.24 0.00 0.00 174.94 174.49 1ui8 s VAL 583 N -2.78 0.74 -0.15 8.37 1.01 -0.07 -2.43 120.40 125.09 1ui8 s VAL 583 Ca 0.32 -0.27 -0.06 0.00 0.00 0.00 0.00 61.98 61.97 1ui8 s VAL 583 Cb 0.04 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 1ui8 s VAL 583 CO 0.15 0.26 0.04 -0.69 0.00 0.00 0.00 175.10 174.86 1ui8 s VAL 584 N 0.64 4.63 -0.27 2.92 1.01 0.71 -1.37 120.40 128.67 1ui8 s VAL 584 Ca -0.10 -0.10 0.03 0.00 0.00 0.00 0.00 61.98 61.81 1ui8 s VAL 584 Cb -0.13 -3.04 0.07 0.00 0.00 0.00 0.00 36.38 33.28 1ui8 s VAL 584 CO 0.01 0.52 -0.08 0.26 0.00 0.00 0.00 175.10 175.81 1ui8 s TRP 585 N -0.07 3.33 -0.26 5.22 0.52 0.37 0.02 118.94 128.07 1ui8 s TRP 585 Ca 0.06 -2.44 -0.09 0.00 0.02 0.00 0.00 56.10 53.65 1ui8 s TRP 585 Cb -0.12 -2.10 -0.04 0.00 -1.15 0.00 0.00 33.47 30.05 1ui8 s TRP 585 CO 0.01 -0.89 0.13 -1.58 0.02 0.00 0.00 176.95 174.65 1ui8 s HIS 586 N 1.07 3.19 -0.12 -1.98 2.46 -0.20 -1.26 115.29 118.44 1ui8 s HIS 586 Ca -0.05 -0.06 -0.18 0.00 0.47 0.00 0.00 55.06 55.23 1ui8 s HIS 586 Cb -0.20 -2.29 -0.04 0.00 -0.13 0.00 0.00 32.58 29.92 1ui8 s HIS 586 CO -0.06 -0.18 0.48 0.99 -2.47 0.00 0.00 174.74 173.51 1ui8 s THR 587 N 1.50 5.18 -0.17 0.89 2.01 -0.24 -0.99 115.64 123.83 1ui8 s THR 587 Ca 0.06 0.96 -0.18 0.00 0.31 0.00 0.00 61.69 62.84 1ui8 s THR 587 Cb -0.15 -3.82 0.05 0.00 0.01 0.00 0.00 72.50 68.59 1ui8 s THR 587 CO 0.07 0.32 0.50 0.72 -0.69 0.00 0.00 174.62 175.53 1ui8 s PHE 588 N 0.69 -0.53 0.29 4.92 -0.71 -0.78 -4.70 117.98 117.15 1ui8 s PHE 588 Ca 0.26 1.25 -0.19 0.00 -1.04 0.00 0.00 56.93 57.21 1ui8 s PHE 588 Cb -0.15 0.19 0.07 0.00 -1.21 0.00 0.00 43.02 41.92 1ui8 s PHE 588 CO 0.10 -0.29 0.92 0.20 -1.34 0.00 0.00 175.22 174.81 1ui8 s GLY 589 N 0.07 0.26 -0.09 1.99 0.00 -1.26 -0.33 107.32 107.96 1ui8 s GLY 589 Ca -0.02 -0.56 -0.01 0.00 0.00 0.00 0.00 44.72 44.13 1ui8 s GLY 589 CO 0.01 1.21 -0.04 1.08 0.00 0.00 0.00 173.10 175.36 1ui8 s LEU 590 N -3.27 3.30 -0.22 0.66 1.43 0.21 -4.67 118.68 116.12 1ui8 s LEU 590 Ca 0.19 0.01 -0.06 0.00 -1.03 0.00 0.00 54.13 53.24 1ui8 s LEU 590 Cb -0.04 -1.74 -0.03 0.00 0.03 0.00 0.00 46.19 44.41 1ui8 s LEU 590 CO 0.08 0.34 0.03 -0.89 0.23 0.00 0.00 176.35 176.15 1ui8 s THR 591 N -0.66 4.18 -0.11 5.49 2.01 -1.26 -0.75 115.64 124.53 1ui8 s THR 591 Ca 0.10 -0.23 0.01 0.00 0.31 0.00 0.00 61.69 61.88 1ui8 s THR 591 Cb -0.12 -2.92 -0.02 0.00 0.01 0.00 0.00 72.50 69.46 1ui8 s THR 591 CO 0.02 0.39 -0.13 0.00 -0.69 0.00 0.00 174.62 174.21 1ui8 s ALA 592 N 1.19 2.64 -0.58 7.40 0.00 0.44 -5.01 121.76 127.84 1ui8 s ALA 592 Ca 0.04 -0.91 0.04 0.00 0.00 0.00 0.00 51.96 51.13 1ui8 s ALA 592 Cb -0.14 -1.16 0.16 0.00 0.00 0.00 0.00 23.12 21.98 1ui8 s ALA 592 CO 0.02 0.32 0.41 -0.06 0.00 0.00 0.00 175.76 176.46 1ui8 s PHE 593 N 0.09 2.68 0.18 0.00 0.08 -1.26 -2.54 117.98 117.20 1ui8 s PHE 593 Ca -0.06 -2.95 -0.32 0.00 0.12 0.00 0.00 56.93 53.73 1ui8 s PHE 593 Cb -0.15 -2.13 -0.16 0.00 -0.57 0.00 0.00 43.02 40.02 1ui8 s PHE 593 CO 0.04 -0.66 1.02 -2.30 -0.10 0.00 0.00 175.22 173.22 1ui8 n PRO 594 N 2.46 0.87 -3.68 0.24 -0.02 -1.26 -4.99 135.00 128.62 1ui8 n PRO 594 Ca 0.20 0.31 -0.20 0.00 -2.02 0.00 0.00 63.50 61.79 1ui8 n PRO 594 Cb 0.38 -1.70 -0.03 0.00 -0.02 0.00 0.00 33.50 32.14 1ui8 n PRO 594 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1ui8 s ARG 595 N -0.63 2.81 0.51 -0.52 0.52 -1.26 -4.76 118.95 115.61 1ui8 s ARG 595 Ca 0.71 -1.25 0.17 0.00 -0.52 0.00 0.00 55.73 54.84 1ui8 s ARG 595 Cb -0.89 -2.56 1.25 0.00 0.52 0.00 0.00 34.95 33.27 1ui8 s ARG 595 CO 0.55 0.05 2.10 0.28 0.02 0.00 0.00 175.30 178.29 1ui8 h VAL 596 N 1.12 0.95 0.00 3.52 2.07 -1.85 0.85 116.25 122.90 1ui8 h VAL 596 Ca -0.44 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.05 1ui8 h VAL 596 Cb 1.26 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.90 1ui8 h VAL 596 CO 0.56 0.01 0.00 -0.33 0.02 0.00 0.00 177.57 177.84 1ui8 h GLU 597 N 0.07 0.00 -0.01 1.57 3.07 -1.94 -2.14 114.58 115.21 1ui8 h GLU 597 Ca 0.08 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.94 1ui8 h GLU 597 Cb 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 1ui8 h GLU 597 CO -0.01 0.00 -0.07 -0.25 -1.40 0.00 0.00 179.01 177.28 1ui8 n ASP 598 N -2.37 0.82 -4.43 1.42 8.00 0.29 -4.57 116.55 115.71 1ui8 n ASP 598 Ca 0.01 -1.01 -0.33 0.00 0.71 0.00 0.00 54.79 54.17 1ui8 n ASP 598 Cb 0.21 -0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.17 1ui8 n ASP 598 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 1ui8 s TRP 599 N -2.23 2.80 -0.62 1.24 -0.11 -0.81 -2.38 118.94 116.82 1ui8 s TRP 599 Ca 0.35 -0.40 0.24 0.00 1.22 0.00 0.00 56.10 57.50 1ui8 s TRP 599 Cb 0.21 -1.77 0.22 0.00 -1.50 0.00 0.00 33.47 30.63 1ui8 s TRP 599 CO 0.42 -0.02 1.20 -0.35 -4.62 0.00 0.00 176.95 173.57 1ui8 n PRO 600 N 3.01 0.29 -3.80 5.86 -0.05 -1.26 -4.96 135.00 134.09 1ui8 n PRO 600 Ca -0.18 0.05 -0.14 0.00 -0.05 0.00 0.00 63.50 63.18 1ui8 n PRO 600 Cb 0.53 -1.65 -0.15 0.00 -0.05 0.00 0.00 33.50 32.17 1ui8 n PRO 600 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 175.50 173.95 1ui8 s ILE 601 N -3.18 -0.04 0.19 0.52 2.07 -1.24 -4.76 121.20 114.76 1ui8 s ILE 601 Ca 0.05 0.16 -0.25 0.00 -1.41 0.00 0.00 60.65 59.21 1ui8 s ILE 601 Cb 0.14 -0.07 -0.08 0.00 0.13 0.00 0.00 42.46 42.58 1ui8 s ILE 601 CO 0.75 0.07 0.78 0.00 -1.91 0.00 0.00 174.94 174.63 1ui8 s MET 602 N 0.80 4.52 0.55 3.50 0.23 -0.42 -4.75 119.30 123.73 1ui8 s MET 602 Ca -0.07 1.13 -0.17 0.00 -1.03 0.00 0.00 55.69 55.56 1ui8 s MET 602 Cb -0.10 -3.17 -0.06 0.00 -1.53 0.00 0.00 34.83 29.98 1ui8 s MET 602 CO -0.02 0.52 1.02 -1.25 -2.03 0.00 0.00 175.02 173.26 1ui8 s PRO 603 N -1.35 3.64 0.26 3.16 0.04 -1.26 -4.21 135.00 135.28 1ui8 s PRO 603 Ca 0.38 1.11 -0.31 0.00 0.04 0.00 0.00 61.00 62.22 1ui8 s PRO 603 Cb -0.22 -2.08 -0.12 0.00 0.04 0.00 0.00 34.50 32.11 1ui8 s PRO 603 CO 0.25 -0.54 1.53 0.28 0.04 0.00 0.00 177.00 178.56 1ui8 n VAL 604 N -1.73 0.87 -4.37 -0.36 0.31 -1.26 -4.77 118.33 107.02 1ui8 n VAL 604 Ca 0.08 -0.22 -0.25 0.00 -0.01 0.00 0.00 64.34 63.94 1ui8 n VAL 604 Cb 0.53 -1.75 -0.12 0.00 -0.91 0.00 0.00 33.84 31.59 1ui8 n VAL 604 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1ui8 s ASP 605 N 0.48 3.08 0.21 4.52 2.15 -0.71 -4.95 116.67 121.45 1ui8 s ASP 605 Ca 0.67 -0.82 0.04 0.00 0.43 0.00 0.00 52.55 52.88 1ui8 s ASP 605 Cb -0.57 -0.21 -0.05 0.00 -0.30 0.00 0.00 42.92 41.80 1ui8 s ASP 605 CO 0.47 0.08 -0.05 0.42 -0.17 0.00 0.00 175.17 175.92 1ui8 s THR 606 N -1.59 1.19 0.04 1.71 -4.23 -1.26 -1.08 115.64 110.43 1ui8 s THR 606 Ca 0.16 -2.07 -0.27 0.00 -1.18 0.00 0.00 61.69 58.33 1ui8 s THR 606 Cb -0.08 -2.16 0.08 0.00 1.34 0.00 0.00 72.50 71.67 1ui8 s THR 606 CO 0.08 -0.48 0.68 0.54 -0.54 0.00 0.00 174.62 174.89 1ui8 s VAL 607 N -3.31 0.00 -0.37 2.29 0.11 -1.04 -4.99 120.40 113.09 1ui8 s VAL 607 Ca 0.24 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.29 1ui8 s VAL 607 Cb 0.04 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.89 1ui8 s VAL 607 CO 0.06 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.44 1ui8 n GLY 608 N 0.20 -0.74 3.79 6.54 0.00 -1.26 -0.71 105.19 113.01 1ui8 n GLY 608 Ca -0.17 -0.37 -0.03 0.00 0.00 0.00 0.00 46.02 45.46 1ui8 n GLY 608 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ui8 s PHE 609 N -3.77 -0.04 0.17 1.61 -0.12 -0.97 -4.18 117.98 110.68 1ui8 s PHE 609 Ca 0.00 -0.28 -0.19 0.00 -0.05 0.00 0.00 56.93 56.41 1ui8 s PHE 609 Cb 0.00 0.65 0.04 0.00 -0.63 0.00 0.00 43.02 43.08 1ui8 s PHE 609 CO 0.00 -0.78 0.53 -1.59 -0.05 0.00 0.00 175.22 173.32 1ui8 s LYS 610 N -2.72 1.28 -0.05 1.99 -2.85 -1.01 -1.67 119.74 114.72 1ui8 s LYS 610 Ca 0.17 -0.70 0.03 0.00 -1.00 0.00 0.00 55.97 54.47 1ui8 s LYS 610 Cb -0.01 0.53 0.01 0.00 -2.06 0.00 0.00 37.83 36.30 1ui8 s LYS 610 CO 0.03 -0.54 -0.13 -0.51 0.10 0.00 0.00 175.35 174.29 1ui8 s LEU 611 N -2.82 1.76 0.04 2.77 1.02 0.53 -0.75 118.68 121.24 1ui8 s LEU 611 Ca 0.05 -0.29 0.08 0.00 0.02 0.00 0.00 54.13 53.99 1ui8 s LEU 611 Cb -0.00 -0.81 -0.03 0.00 0.02 0.00 0.00 46.19 45.37 1ui8 s LEU 611 CO -0.08 0.08 -0.22 -0.13 0.02 0.00 0.00 176.35 176.02 1ui8 s ARG 612 N 0.36 1.95 0.39 1.70 0.52 0.24 -1.63 118.95 122.48 1ui8 s ARG 612 Ca -0.09 -1.04 -0.27 0.00 -0.52 0.00 0.00 55.73 53.82 1ui8 s ARG 612 Cb -0.13 -2.09 -0.11 0.00 0.52 0.00 0.00 34.95 33.14 1ui8 s ARG 612 CO 0.02 0.53 1.38 -0.35 0.02 0.00 0.00 175.30 176.90 1ui8 n PRO 613 N 1.66 2.30 -3.61 3.54 -0.04 -1.26 0.04 135.00 137.62 1ui8 n PRO 613 Ca -0.17 0.81 -0.28 0.00 -0.04 0.00 0.00 63.50 63.82 1ui8 n PRO 613 Cb 0.52 -2.52 -0.12 0.00 -0.04 0.00 0.00 33.50 31.35 1ui8 n PRO 613 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1ui8 s GLU 614 N -2.15 1.36 -0.90 0.54 2.56 0.07 -4.71 118.70 115.48 1ui8 s GLU 614 Ca 0.57 -2.31 0.00 0.00 0.00 0.00 0.00 54.97 53.23 1ui8 s GLU 614 Cb -0.50 -2.15 0.00 0.00 2.00 0.00 0.00 34.13 33.48 1ui8 s GLU 614 CO 0.61 -1.28 0.00 0.41 -0.56 0.00 0.00 175.26 174.43 1ui8 n GLY 615 N 2.94 0.57 0.15 -1.50 0.00 -1.26 -2.50 105.19 103.59 1ui8 n GLY 615 Ca 0.20 -0.56 -0.21 0.00 0.00 0.00 0.00 46.02 45.45 1ui8 n GLY 615 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1ui8 h PHE 616 N 0.00 0.85 -1.80 1.61 3.57 -1.87 -3.36 116.94 115.95 1ui8 h PHE 616 Ca -0.20 -0.54 -0.43 0.00 3.53 0.00 0.00 57.97 60.32 1ui8 h PHE 616 Cb 0.87 -0.06 0.03 0.00 2.79 0.00 0.00 35.95 39.58 1ui8 h PHE 616 CO 0.25 1.39 -0.17 -0.06 -2.23 0.00 0.00 178.31 177.50 1ui8 s PHE 617 N -2.89 2.76 -1.04 0.41 0.40 -1.26 -4.86 117.98 111.51 1ui8 s PHE 617 Ca -0.11 -0.28 0.25 0.00 -0.60 0.00 0.00 56.93 56.19 1ui8 s PHE 617 Cb 0.04 -2.51 0.46 0.00 0.51 0.00 0.00 43.02 41.52 1ui8 s PHE 617 CO 0.89 -0.62 1.38 -0.25 0.70 0.00 0.00 175.22 177.32 1ui8 n ASP 618 N -2.05 0.57 -3.79 1.36 8.00 -1.26 -4.86 116.55 114.52 1ui8 n ASP 618 Ca 0.08 -0.34 0.03 0.00 0.71 0.00 0.00 54.79 55.27 1ui8 n ASP 618 Cb 0.59 0.30 0.01 0.00 -0.02 0.00 0.00 41.12 42.01 1ui8 n ASP 618 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ui8 s ARG 619 N -2.98 0.33 0.05 -1.24 1.70 -1.26 -4.93 118.95 110.63 1ui8 s ARG 619 Ca 0.11 -0.21 -0.36 0.00 -0.47 0.00 0.00 55.73 54.81 1ui8 s ARG 619 Cb 0.17 0.10 -0.15 0.00 -0.57 0.00 0.00 34.95 34.50 1ui8 s ARG 619 CO 0.70 -0.15 1.54 0.45 -1.08 0.00 0.00 175.30 176.76 1ui8 n SER 620 N -0.92 2.47 -0.15 -2.89 2.88 -1.26 -4.84 113.62 108.90 1ui8 n SER 620 Ca 0.01 1.08 0.06 0.00 -1.33 0.00 0.00 58.87 58.69 1ui8 n SER 620 Cb 0.60 -1.29 0.28 0.00 -0.75 0.00 0.00 64.21 63.04 1ui8 n SER 620 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1ui8 n PRO 621 N 3.65 1.19 -0.37 -1.46 -0.04 -1.26 -3.86 135.00 132.86 1ui8 n PRO 621 Ca 0.19 -0.29 0.07 0.00 -0.04 0.00 0.00 63.50 63.43 1ui8 n PRO 621 Cb 0.23 -1.19 0.19 0.00 -0.04 0.00 0.00 33.50 32.69 1ui8 n PRO 621 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1ui8 n VAL 622 N -0.38 2.14 0.26 0.52 0.24 -1.26 -4.64 118.33 115.21 1ui8 n VAL 622 Ca 0.09 -2.42 0.15 0.00 -2.04 0.00 0.00 64.34 60.11 1ui8 n VAL 622 Cb 0.10 -0.26 0.54 0.00 -1.47 0.00 0.00 33.84 32.75 1ui8 n VAL 622 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1ui8 h LEU 623 N 0.76 0.00 -1.20 1.34 3.38 -1.98 -2.94 115.31 114.67 1ui8 h LEU 623 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1ui8 h LEU 623 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1ui8 h LEU 623 CO 0.11 0.05 0.00 -0.90 0.09 0.00 0.00 178.44 177.79 1ui8 n ASP 624 N -3.14 1.80 -4.72 -0.43 5.75 -1.26 -4.88 116.55 109.67 1ui8 n ASP 624 Ca 0.01 -1.75 -0.42 0.00 -0.01 0.00 0.00 54.79 52.62 1ui8 n ASP 624 Cb 0.38 -0.13 -0.03 0.00 -1.03 0.00 0.00 41.12 40.31 1ui8 n ASP 624 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 1ui8 s VAL 625 N -1.75 4.33 0.93 2.12 -7.23 -1.12 -5.02 120.40 112.67 1ui8 s VAL 625 Ca 0.32 1.73 -0.14 0.00 -1.81 0.00 0.00 61.98 62.08 1ui8 s VAL 625 Cb 0.17 -4.11 0.15 0.00 0.56 0.00 0.00 36.38 33.16 1ui8 s VAL 625 CO 0.26 0.17 1.18 -2.16 -0.31 0.00 0.00 175.10 174.24 1ui8 s PRO 626 N 0.76 0.97 0.42 4.82 0.04 -1.26 -5.06 135.00 135.69 1ui8 s PRO 626 Ca 0.54 0.06 -0.19 0.00 0.04 0.00 0.00 61.00 61.45 1ui8 s PRO 626 Cb -0.26 -1.84 -0.10 0.00 0.04 0.00 0.00 34.50 32.34 1ui8 s PRO 626 CO 0.30 -2.27 0.92 0.00 0.04 0.00 0.00 177.00 175.98 1ui8 s ALA 627 N -3.45 3.10 -2.00 8.56 0.00 -1.26 -4.82 121.76 121.89 1ui8 s ALA 627 Ca 0.66 0.29 0.21 0.00 0.00 0.00 0.00 51.96 53.13 1ui8 s ALA 627 Cb -0.11 -3.07 1.25 0.00 0.00 0.00 0.00 23.12 21.19 1ui8 s ALA 627 CO 0.53 0.11 1.63 0.09 0.00 0.00 0.00 175.76 178.11