#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i05 h TYR 17 N 0.00 0.43 -0.21 -2.53 0.05 -2.06 -3.24 116.97 109.40 3i05 h TYR 17 Ca 0.00 -0.31 -0.01 0.00 0.05 0.00 0.00 58.73 58.46 3i05 h TYR 17 Cb 0.00 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 37.71 3i05 h TYR 17 CO 0.00 1.44 0.08 -0.44 -1.05 0.00 0.00 178.16 178.19 3i05 h ASP 18 N 0.06 0.26 -0.63 3.88 3.32 -2.03 -0.27 116.42 121.02 3i05 h ASP 18 Ca -0.30 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 56.65 3i05 h ASP 18 Cb 2.03 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 41.49 3i05 h ASP 18 CO 0.14 0.25 0.06 0.11 -1.72 0.00 0.00 179.24 178.08 3i05 h LYS 19 N 0.30 1.07 -0.20 3.56 6.56 -2.01 -2.80 116.57 123.05 3i05 h LYS 19 Ca 0.08 -0.31 -0.02 0.00 -1.06 0.00 0.00 60.65 59.33 3i05 h LYS 19 Cb 0.08 -0.11 -0.01 0.00 -0.57 0.00 0.00 32.23 31.62 3i05 h LYS 19 CO -0.01 1.01 0.03 -0.07 -2.06 0.00 0.00 179.45 178.35 3i05 h LEU 20 N 0.98 0.32 -0.82 2.94 3.38 -1.26 -2.86 115.31 117.99 3i05 h LEU 20 Ca 0.19 -0.27 0.18 0.00 0.09 0.00 0.00 57.88 58.07 3i05 h LEU 20 Cb 0.49 -0.09 -0.11 0.00 0.09 0.00 0.00 40.66 41.04 3i05 h LEU 20 CO 0.02 0.51 0.31 0.40 0.09 0.00 0.00 178.44 179.77 3i05 h ILE 21 N 0.12 0.53 -0.27 1.22 2.04 -1.12 -2.04 117.51 117.99 3i05 h ILE 21 Ca 0.06 -0.13 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 3i05 h ILE 21 Cb 0.33 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.51 3i05 h ILE 21 CO 0.00 0.07 0.07 0.11 0.00 0.00 0.00 178.15 178.40 3i05 h LYS 22 N 0.38 0.43 -0.71 2.37 1.57 -1.28 0.20 116.57 119.53 3i05 h LYS 22 Ca 0.48 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 3i05 h LYS 22 Cb 0.85 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.10 3i05 h LYS 22 CO -0.49 0.52 0.00 -0.40 -0.57 0.00 0.00 179.45 178.50 3i05 n ASP 23 N -4.70 3.88 -0.59 0.86 5.68 -1.07 -4.16 116.55 116.45 3i05 n ASP 23 Ca -0.03 -2.00 0.13 0.00 -0.50 0.00 0.00 54.79 52.39 3i05 n ASP 23 Cb 0.18 -0.47 0.28 0.00 -1.14 0.00 0.00 41.12 39.97 3i05 n ASP 23 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 3i05 n PHE 24 N 1.63 0.00 -1.88 2.11 3.72 -0.79 -5.01 117.46 117.24 3i05 n PHE 24 Ca 0.24 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.27 3i05 n PHE 24 Cb 0.62 -0.02 0.04 0.00 -0.94 0.00 0.00 39.48 39.17 3i05 n PHE 24 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3i05 s GLY 25 N -2.16 2.84 0.00 1.37 0.00 -1.26 -4.96 107.32 103.15 3i05 s GLY 25 Ca 0.29 1.21 0.00 0.00 0.00 0.00 0.00 44.72 46.22 3i05 s GLY 25 CO 0.39 1.68 0.00 -1.26 0.00 0.00 0.00 173.10 173.91 3i05 n SER 26 N -1.20 0.27 -3.78 1.64 2.88 0.69 -5.02 113.62 109.09 3i05 n SER 26 Ca 0.11 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.52 3i05 n SER 26 Cb 0.47 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.78 3i05 n SER 26 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 3i05 s HIS 27 N 0.65 -0.07 0.56 0.66 3.76 -0.98 -4.91 115.29 114.96 3i05 s HIS 27 Ca 0.00 0.28 -0.18 0.00 -0.15 0.00 0.00 55.06 55.01 3i05 s HIS 27 Cb 0.00 -0.12 -0.05 0.00 1.11 0.00 0.00 32.58 33.52 3i05 s HIS 27 CO 0.00 -0.11 1.11 0.00 -0.85 0.00 0.00 174.74 174.89 3i05 s ALA 28 N 0.88 2.68 -0.62 -1.40 0.00 -1.26 -0.36 121.76 121.68 3i05 s ALA 28 Ca -0.07 0.70 -0.22 0.00 0.00 0.00 0.00 51.96 52.36 3i05 s ALA 28 Cb -0.10 -3.32 0.07 0.00 0.00 0.00 0.00 23.12 19.77 3i05 s ALA 28 CO -0.03 -0.81 0.90 0.42 0.00 0.00 0.00 175.76 176.23 3i05 s ILE 29 N -1.98 4.45 0.89 0.00 1.01 0.23 -4.76 121.20 121.03 3i05 s ILE 29 Ca 0.70 -0.33 -0.11 0.00 0.00 0.00 0.00 60.65 60.92 3i05 s ILE 29 Cb -0.21 -4.60 0.18 0.00 0.01 0.00 0.00 42.46 37.84 3i05 s ILE 29 CO 0.30 -1.29 1.22 1.51 0.00 0.00 0.00 174.94 176.67 3i05 s ASP 30 N 3.42 3.46 0.32 3.58 -4.77 -1.26 -4.95 116.67 116.47 3i05 s ASP 30 Ca 0.22 -0.01 0.03 0.00 -3.30 0.00 0.00 52.55 49.49 3i05 s ASP 30 Cb -0.17 -0.11 0.53 0.00 -1.09 0.00 0.00 42.92 42.08 3i05 s ASP 30 CO 0.12 -2.48 1.83 -0.33 0.70 0.00 0.00 175.17 175.01 3i05 h GLU 31 N -1.28 0.56 -0.72 2.11 5.08 -2.00 -2.87 114.58 115.45 3i05 h GLU 31 Ca -0.41 -0.14 0.03 0.00 -1.00 0.00 0.00 59.36 57.84 3i05 h GLU 31 Cb 1.24 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.38 3i05 h GLU 31 CO 0.37 0.61 0.46 0.00 -1.00 0.00 0.00 179.01 179.45 3i05 h ALA 32 N 1.44 0.94 0.00 3.43 0.00 -1.99 -1.39 119.26 121.68 3i05 h ALA 32 Ca 0.11 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 3i05 h ALA 32 Cb 0.40 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3i05 h ALA 32 CO 0.02 0.25 -0.46 1.25 0.00 0.00 0.00 179.25 180.31 3i05 h LEU 33 N 0.90 0.00 -0.29 0.00 5.85 -1.90 -1.53 115.31 118.34 3i05 h LEU 33 Ca 0.28 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.85 3i05 h LEU 33 Cb -0.00 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 3i05 h LEU 33 CO -0.10 0.46 -0.41 -0.07 -0.34 0.00 0.00 178.44 177.98 3i05 h LEU 34 N 0.00 0.86 -1.09 2.25 4.07 -1.23 -1.42 115.31 118.76 3i05 h LEU 34 Ca -0.00 -0.51 -0.06 0.00 0.08 0.00 0.00 57.88 57.39 3i05 h LEU 34 Cb 0.88 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 42.36 3i05 h LEU 34 CO 0.06 1.20 0.03 -0.33 -1.08 0.00 0.00 178.44 178.31 3i05 h GLU 35 N 0.55 0.67 -0.14 1.13 3.07 -1.08 -1.42 114.58 117.37 3i05 h GLU 35 Ca 0.03 -0.15 -0.02 0.00 -0.50 0.00 0.00 59.36 58.72 3i05 h GLU 35 Cb 1.00 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.82 3i05 h GLU 35 CO 0.10 0.67 0.01 -0.09 -1.40 0.00 0.00 179.01 178.30 3i05 h ARG 36 N 0.64 0.23 -0.91 2.33 2.43 -1.11 -1.95 114.38 116.04 3i05 h ARG 36 Ca 0.13 -0.07 0.07 0.00 -0.81 0.00 0.00 59.98 59.30 3i05 h ARG 36 Cb 0.36 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.82 3i05 h ARG 36 CO 0.01 0.44 0.57 0.82 -1.51 0.00 0.00 179.97 180.31 3i05 h ILE 37 N -0.01 1.05 -0.01 1.20 2.04 -1.10 -1.50 117.51 119.18 3i05 h ILE 37 Ca 0.04 -0.35 -0.00 0.00 1.00 0.00 0.00 64.86 65.55 3i05 h ILE 37 Cb 0.33 -0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.34 3i05 h ILE 37 CO 0.00 0.19 0.00 -0.08 0.00 0.00 0.00 178.15 178.27 3i05 h GLU 38 N 1.03 0.01 0.00 2.37 4.81 -0.96 -1.82 114.58 120.02 3i05 h GLU 38 Ca 0.40 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.57 3i05 h GLU 38 Cb 0.19 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 3i05 h GLU 38 CO -0.18 0.14 -0.29 0.07 -0.73 0.00 0.00 179.01 178.02 3i05 h ARG 39 N -0.13 0.00 -0.36 1.92 0.11 -1.16 0.16 114.38 114.93 3i05 h ARG 39 Ca 0.00 0.00 -0.15 0.00 0.10 0.00 0.00 59.98 59.93 3i05 h ARG 39 Cb 0.14 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.21 3i05 h ARG 39 CO -0.00 0.29 -0.36 0.28 0.10 0.00 0.00 179.97 180.28 3i05 h VAL 40 N 0.00 1.28 0.00 0.08 2.07 -1.09 -3.29 116.25 115.30 3i05 h VAL 40 Ca -0.00 -1.53 0.00 0.00 0.82 0.00 0.00 66.70 65.98 3i05 h VAL 40 Cb 0.77 1.44 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 3i05 h VAL 40 CO 0.04 0.51 -1.12 0.18 0.02 0.00 0.00 177.57 177.19 3i05 n LEU 41 N -4.12 0.68 -0.51 2.57 4.32 -0.70 -4.97 117.00 114.26 3i05 n LEU 41 Ca -0.03 0.22 -0.07 0.00 -0.02 0.00 0.00 56.01 56.12 3i05 n LEU 41 Cb 0.53 -0.07 -0.03 0.00 -1.62 0.00 0.00 43.42 42.23 3i05 n LEU 41 CO 0.48 -0.12 -0.06 0.61 -1.22 0.00 0.00 177.39 177.08 3i05 n GLY 42 N 1.23 0.89 3.37 -0.72 0.00 0.53 -5.00 105.19 105.49 3i05 n GLY 42 Ca -0.00 -0.70 -0.17 0.00 0.00 0.00 0.00 46.02 45.15 3i05 n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i05 s LYS 43 N -2.51 1.78 0.42 1.61 1.02 -1.16 -5.04 119.74 115.86 3i05 s LYS 43 Ca 0.00 -1.88 -0.23 0.00 0.02 0.00 0.00 55.97 53.88 3i05 s LYS 43 Cb 0.00 0.37 -0.09 0.00 -0.52 0.00 0.00 37.83 37.59 3i05 s LYS 43 CO 0.00 -0.69 1.05 -1.59 -0.92 0.00 0.00 175.35 173.20 3i05 s LYS 44 N -3.34 4.08 0.81 1.68 -2.85 -1.26 -4.37 119.74 114.49 3i05 s LYS 44 Ca 0.36 1.48 -0.12 0.00 -1.00 0.00 0.00 55.97 56.69 3i05 s LYS 44 Cb 0.02 -2.43 0.08 0.00 -2.06 0.00 0.00 37.83 33.43 3i05 s LYS 44 CO 0.23 -0.21 1.15 -2.14 0.10 0.00 0.00 175.35 174.48 3i05 s PRO 45 N -2.67 1.77 0.64 1.78 0.02 -1.26 -4.99 135.00 130.29 3i05 s PRO 45 Ca 0.60 1.50 -0.17 0.00 0.02 0.00 0.00 61.00 62.95 3i05 s PRO 45 Cb -0.21 -1.82 -0.05 0.00 0.02 0.00 0.00 34.50 32.45 3i05 s PRO 45 CO 0.26 -2.06 0.76 1.58 -0.33 0.00 0.00 177.00 177.20 3i05 n HIS 46 N -3.51 0.06 0.29 6.54 -0.00 -1.26 -4.69 115.22 112.66 3i05 n HIS 46 Ca 0.11 0.41 0.14 0.00 0.46 0.00 0.00 57.72 58.84 3i05 n HIS 46 Cb 0.52 -2.03 0.87 0.00 -0.12 0.00 0.00 29.99 29.23 3i05 n HIS 46 CO 0.00 0.00 0.00 1.12 0.46 0.00 0.00 176.34 177.92 3i05 h HIS 47 N 0.10 0.00 -0.94 1.57 2.07 -1.94 -1.60 115.15 114.41 3i05 h HIS 47 Ca -0.47 0.00 0.04 0.00 -2.85 0.00 0.00 60.37 57.09 3i05 h HIS 47 Cb 1.37 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 31.29 3i05 h HIS 47 CO 0.35 0.00 0.61 0.74 -3.07 0.00 0.00 177.93 176.56 3i05 h PHE 48 N 0.00 1.14 0.01 6.12 0.04 -1.90 0.77 116.94 123.12 3i05 h PHE 48 Ca -0.00 0.03 -0.14 0.00 2.80 0.00 0.00 57.97 60.66 3i05 h PHE 48 Cb 0.00 -0.38 0.01 0.00 2.20 0.00 0.00 35.95 37.78 3i05 h PHE 48 CO 0.00 0.64 -0.55 -0.07 -0.60 0.00 0.00 178.31 177.74 3i05 h LEU 49 N 1.17 0.47 -0.88 1.54 3.38 -1.54 0.80 115.31 120.25 3i05 h LEU 49 Ca 0.38 -0.78 -0.00 0.00 0.09 0.00 0.00 57.88 57.57 3i05 h LEU 49 Cb 0.04 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 3i05 h LEU 49 CO -0.13 1.19 0.54 0.03 0.09 0.00 0.00 178.44 180.15 3i05 h ARG 50 N -0.21 1.19 -0.01 1.13 3.08 -1.22 -2.04 114.38 116.29 3i05 h ARG 50 Ca -0.07 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 59.88 3i05 h ARG 50 Cb 1.28 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 31.08 3i05 h ARG 50 CO 0.11 0.83 -0.06 0.54 -1.07 0.00 0.00 179.97 180.31 3i05 n ARG 51 N -4.42 1.34 -2.65 0.04 1.74 0.25 -4.94 116.66 108.02 3i05 n ARG 51 Ca 0.09 -0.70 -0.10 0.00 -0.77 0.00 0.00 57.85 56.37 3i05 n ARG 51 Cb 0.05 -1.49 0.02 0.00 -1.02 0.00 0.00 32.46 30.03 3i05 n ARG 51 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3i05 n GLY 52 N 1.20 0.15 0.10 -0.13 0.00 -0.77 -4.94 105.19 100.79 3i05 n GLY 52 Ca 0.18 -0.35 -0.19 0.00 0.00 0.00 0.00 46.02 45.66 3i05 n GLY 52 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3i05 h ILE 53 N -0.71 1.35 -3.52 -0.61 2.04 0.36 -3.39 117.51 113.03 3i05 h ILE 53 Ca -0.24 -2.34 -0.62 0.00 1.00 0.00 0.00 64.86 62.65 3i05 h ILE 53 Cb 1.17 2.90 -0.13 0.00 -0.74 0.00 0.00 36.82 40.03 3i05 h ILE 53 CO 0.26 0.57 0.42 -0.36 0.00 0.00 0.00 178.15 179.03 3i05 s PHE 54 N -2.35 2.94 0.00 1.37 0.40 -0.91 -0.19 117.98 119.24 3i05 s PHE 54 Ca -0.21 0.12 0.00 0.00 -0.60 0.00 0.00 56.93 56.24 3i05 s PHE 54 Cb 0.02 -3.79 0.00 0.00 0.51 0.00 0.00 43.02 39.76 3i05 s PHE 54 CO 0.70 -1.08 0.00 1.97 0.70 0.00 0.00 175.22 177.51 3i05 n PHE 55 N 6.91 0.00 -4.35 0.36 -1.74 -0.07 -4.49 117.46 114.08 3i05 n PHE 55 Ca 0.02 0.00 -0.18 0.00 -0.56 0.00 0.00 57.45 56.73 3i05 n PHE 55 Cb 0.48 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.38 3i05 n PHE 55 CO 0.00 0.00 0.00 0.45 -0.56 0.00 0.00 176.76 176.65 3i05 s SER 56 N -1.73 1.98 0.18 5.98 0.15 -1.21 0.75 113.70 119.80 3i05 s SER 56 Ca 0.00 -1.23 -0.24 0.00 0.70 0.00 0.00 55.95 55.19 3i05 s SER 56 Cb 0.00 -0.02 0.05 0.00 -1.71 0.00 0.00 66.02 64.35 3i05 s SER 56 CO 0.00 -0.50 0.77 -1.38 1.20 0.00 0.00 173.24 173.34 3i05 s HIS 57 N -3.36 -0.28 -0.04 3.44 -3.43 0.51 0.25 115.29 112.38 3i05 s HIS 57 Ca 0.29 -0.04 0.01 0.00 -0.80 0.00 0.00 55.06 54.53 3i05 s HIS 57 Cb 0.06 0.63 0.02 0.00 -1.43 0.00 0.00 32.58 31.86 3i05 s HIS 57 CO 0.10 -0.95 -0.06 1.03 -2.00 0.00 0.00 174.74 172.85 3i05 s ARG 58 N -3.61 0.93 -1.11 -0.38 0.52 0.15 -2.32 118.95 113.11 3i05 s ARG 58 Ca 0.08 -0.17 0.00 0.00 -0.52 0.00 0.00 55.73 55.12 3i05 s ARG 58 Cb -0.03 -0.88 0.00 0.00 0.52 0.00 0.00 34.95 34.56 3i05 s ARG 58 CO -0.01 -0.03 0.00 -0.25 0.02 0.00 0.00 175.30 175.03 3i05 n ASP 59 N 3.85 -5.68 -0.24 0.23 8.00 -1.26 -1.96 116.55 119.49 3i05 n ASP 59 Ca -0.24 0.26 -0.04 0.00 0.71 0.00 0.00 54.79 55.48 3i05 n ASP 59 Cb 0.52 -4.10 0.13 0.00 -0.02 0.00 0.00 41.12 37.64 3i05 n ASP 59 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3i05 h LEU 60 N 0.00 0.98 -0.35 0.64 5.85 -1.90 -1.18 115.31 119.35 3i05 h LEU 60 Ca -0.21 -0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.40 3i05 h LEU 60 Cb 1.16 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.90 3i05 h LEU 60 CO 0.31 0.86 0.15 -0.55 -0.34 0.00 0.00 178.44 178.88 3i05 h ASN 61 N 1.04 0.20 -0.37 1.25 7.08 -1.99 0.37 115.58 123.16 3i05 h ASN 61 Ca 0.24 0.02 0.06 0.00 -3.08 0.00 0.00 56.30 53.55 3i05 h ASN 61 Cb 0.19 -0.01 -0.05 0.00 -2.08 0.00 0.00 38.32 36.37 3i05 h ASN 61 CO -0.02 0.16 0.08 -0.07 -2.08 0.00 0.00 177.43 175.49 3i05 h LEU 62 N 0.32 0.01 -0.40 6.14 4.07 -1.84 0.10 115.31 123.72 3i05 h LEU 62 Ca 0.15 0.06 0.01 0.00 0.08 0.00 0.00 57.88 58.18 3i05 h LEU 62 Cb 0.09 0.08 -0.02 0.00 1.08 0.00 0.00 40.66 41.89 3i05 h LEU 62 CO -0.12 0.04 0.26 0.25 -1.08 0.00 0.00 178.44 177.79 3i05 h LEU 63 N 0.20 0.44 -0.69 1.67 6.46 -0.55 -1.27 115.31 121.58 3i05 h LEU 63 Ca 0.18 -0.01 -0.04 0.00 -0.12 0.00 0.00 57.88 57.89 3i05 h LEU 63 Cb 0.21 -0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 40.00 3i05 h LEU 63 CO -0.23 0.32 0.26 -0.07 -0.62 0.00 0.00 178.44 178.10 3i05 h LEU 64 N 0.53 0.96 -0.18 2.25 3.38 -0.50 -1.01 115.31 120.74 3i05 h LEU 64 Ca 0.15 -0.18 0.05 0.00 0.09 0.00 0.00 57.88 57.99 3i05 h LEU 64 Cb -0.05 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.38 3i05 h LEU 64 CO -0.04 0.89 -0.31 0.44 0.09 0.00 0.00 178.44 179.51 3i05 h ASP 65 N 0.99 -0.97 -0.70 -0.43 3.32 -0.34 -0.19 116.42 118.11 3i05 h ASP 65 Ca 0.23 0.15 0.15 0.00 0.02 0.00 0.00 57.03 57.58 3i05 h ASP 65 Cb 0.23 0.42 -0.11 0.00 0.22 0.00 0.00 39.33 40.10 3i05 h ASP 65 CO -0.02 -0.34 0.14 0.58 -1.72 0.00 0.00 179.24 177.88 3i05 h VAL 66 N -0.35 0.52 -0.30 -1.35 2.07 -0.71 -2.38 116.25 113.75 3i05 h VAL 66 Ca 0.11 -0.08 -0.07 0.00 0.82 0.00 0.00 66.70 67.48 3i05 h VAL 66 Cb 0.53 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 3i05 h VAL 66 CO -0.38 0.04 -0.08 0.22 0.02 0.00 0.00 177.57 177.39 3i05 h TYR 67 N 0.24 0.66 0.00 1.57 3.20 -0.30 -2.48 116.97 119.86 3i05 h TYR 67 Ca 0.39 -0.15 0.00 0.00 3.14 0.00 0.00 58.73 62.11 3i05 h TYR 67 Cb 0.65 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.76 3i05 h TYR 67 CO -0.28 0.78 0.00 0.93 -1.64 0.00 0.00 178.16 177.95 3i05 h GLU 68 N 0.35 0.00 -0.01 1.82 5.08 -0.71 -0.86 114.58 120.25 3i05 h GLU 68 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3i05 h GLU 68 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 3i05 h GLU 68 CO 0.03 0.00 -0.01 0.43 -1.00 0.00 0.00 179.01 178.46 3i05 n SER 69 N -2.50 0.89 0.00 1.42 7.64 -0.93 -4.93 113.62 115.22 3i05 n SER 69 Ca 0.01 -1.26 0.00 0.00 1.01 0.00 0.00 58.87 58.63 3i05 n SER 69 Cb 0.19 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 3i05 n SER 69 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3i05 n GLY 70 N 1.12 0.98 3.78 0.23 0.00 -0.33 -5.07 105.19 105.90 3i05 n GLY 70 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 3i05 n GLY 70 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3i05 s GLN 71 N -0.53 3.03 0.51 1.61 -0.21 -0.96 -5.02 119.66 118.09 3i05 s GLN 71 Ca 0.00 1.39 -0.05 0.00 0.02 0.00 0.00 55.36 56.72 3i05 s GLN 71 Cb 0.00 -1.98 -0.02 0.00 1.00 0.00 0.00 33.01 32.01 3i05 s GLN 71 CO 0.00 -1.07 0.82 -1.25 -2.12 0.00 0.00 175.29 171.67 3i05 s PRO 72 N -3.93 3.34 0.30 2.91 0.04 -1.26 -4.26 135.00 132.14 3i05 s PRO 72 Ca 0.67 0.12 0.06 0.00 0.04 0.00 0.00 61.00 61.89 3i05 s PRO 72 Cb -0.20 -2.35 -0.02 0.00 0.04 0.00 0.00 34.50 31.97 3i05 s PRO 72 CO 0.37 -0.36 0.20 1.97 0.04 0.00 0.00 177.00 179.23 3i05 n PHE 73 N -2.36 -0.43 -4.05 0.56 1.16 -1.26 -4.17 117.46 106.91 3i05 n PHE 73 Ca 0.02 -2.32 -0.10 0.00 -1.87 0.00 0.00 57.45 53.17 3i05 n PHE 73 Cb 0.56 0.17 -0.08 0.00 -1.61 0.00 0.00 39.48 38.52 3i05 n PHE 73 CO 0.00 0.00 0.00 1.52 -1.87 0.00 0.00 176.76 176.41 3i05 s TYR 74 N -3.05 0.64 0.09 2.97 1.13 0.10 -4.17 117.35 115.06 3i05 s TYR 74 Ca 0.29 -0.98 0.05 0.00 -1.41 0.00 0.00 57.07 55.02 3i05 s TYR 74 Cb 0.01 -0.21 -0.04 0.00 -1.10 0.00 0.00 41.96 40.62 3i05 s TYR 74 CO 0.20 -0.70 -0.01 -0.51 -2.51 0.00 0.00 175.55 172.02 3i05 s LEU 75 N -3.03 3.43 -0.17 -3.49 1.43 -0.17 -0.67 118.68 116.01 3i05 s LEU 75 Ca 0.24 -0.20 -0.04 0.00 -1.03 0.00 0.00 54.13 53.10 3i05 s LEU 75 Cb 0.04 -2.16 0.07 0.00 0.03 0.00 0.00 46.19 44.17 3i05 s LEU 75 CO 0.04 0.18 0.16 -0.47 0.23 0.00 0.00 176.35 176.48 3i05 s TYR 76 N -1.30 -0.07 0.34 0.29 5.04 -0.92 -0.88 117.35 119.84 3i05 s TYR 76 Ca 0.25 0.06 0.06 0.00 -2.44 0.00 0.00 57.07 55.01 3i05 s TYR 76 Cb -0.12 -0.48 -0.07 0.00 0.35 0.00 0.00 41.96 41.65 3i05 s TYR 76 CO 0.18 -0.51 -0.01 -0.08 -1.34 0.00 0.00 175.55 173.79 3i05 s THR 77 N 2.25 1.68 0.38 4.34 -1.32 -0.92 -4.28 115.64 117.76 3i05 s THR 77 Ca 0.04 -2.06 0.05 0.00 -1.21 0.00 0.00 61.69 58.51 3i05 s THR 77 Cb -0.15 -2.73 -0.03 0.00 -1.51 0.00 0.00 72.50 68.08 3i05 s THR 77 CO -0.10 -0.11 0.19 -0.83 -2.21 0.00 0.00 174.62 171.56 3i05 s GLY 78 N -3.55 2.51 -0.28 6.08 0.00 -1.26 -1.94 107.32 108.88 3i05 s GLY 78 Ca 0.34 -1.55 -0.08 0.00 0.00 0.00 0.00 44.72 43.42 3i05 s GLY 78 CO 0.15 -1.68 0.60 -1.60 0.00 0.00 0.00 173.10 170.57 3i05 s ARG 79 N -3.60 0.53 -0.14 2.90 6.06 0.33 -4.85 118.95 120.18 3i05 s ARG 79 Ca 0.30 1.31 -0.28 0.00 -2.50 0.00 0.00 55.73 54.56 3i05 s ARG 79 Cb 0.02 0.71 -0.01 0.00 0.06 0.00 0.00 34.95 35.73 3i05 s ARG 79 CO 0.20 -0.27 0.96 0.20 -2.50 0.00 0.00 175.30 173.89 3i05 s GLY 80 N 2.84 2.22 0.30 8.12 0.00 -1.26 -2.62 107.32 116.90 3i05 s GLY 80 Ca -0.02 0.26 -0.30 0.00 0.00 0.00 0.00 44.72 44.66 3i05 s GLY 80 CO -0.18 1.87 1.56 -4.14 0.00 0.00 0.00 173.10 172.21 3i05 s PRO 81 N 2.17 4.14 0.21 2.90 0.02 -1.26 -4.99 135.00 138.18 3i05 s PRO 81 Ca 0.45 2.55 0.09 0.00 0.02 0.00 0.00 61.00 64.11 3i05 s PRO 81 Cb -0.17 -3.03 -0.05 0.00 0.02 0.00 0.00 34.50 31.27 3i05 s PRO 81 CO 0.15 -0.60 -0.18 -1.54 -0.33 0.00 0.00 177.00 174.51 3i05 s SER 82 N 0.41 2.91 -0.86 2.53 1.04 -1.26 -4.97 113.70 113.50 3i05 s SER 82 Ca 0.62 -0.96 -0.04 0.00 0.48 0.00 0.00 55.95 56.05 3i05 s SER 82 Cb -0.47 -0.19 0.14 0.00 0.10 0.00 0.00 66.02 65.60 3i05 s SER 82 CO 0.49 -0.06 2.45 -1.54 0.98 0.00 0.00 173.24 175.56 3i05 n SER 83 N -0.17 7.23 -0.67 7.02 3.41 -1.26 -4.81 113.62 124.37 3i05 n SER 83 Ca -0.09 -3.32 0.00 0.00 -0.26 0.00 0.00 58.87 55.20 3i05 n SER 83 Cb 0.59 -1.25 0.00 0.00 -0.26 0.00 0.00 64.21 63.29 3i05 n SER 83 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 3i05 n GLU 84 N 0.88 0.00 -4.40 4.33 2.13 -1.26 -5.17 120.64 117.15 3i05 n GLU 84 Ca 0.54 0.00 -0.28 0.00 0.66 0.00 0.00 57.16 58.08 3i05 n GLU 84 Cb 0.38 0.00 -0.12 0.00 0.27 0.00 0.00 31.44 31.97 3i05 n GLU 84 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 3i05 s SER 85 N -0.01 3.48 0.45 4.31 0.15 -1.26 -4.90 113.70 115.92 3i05 s SER 85 Ca 0.00 -0.80 -0.24 0.00 0.70 0.00 0.00 55.95 55.60 3i05 s SER 85 Cb 0.00 -0.29 -0.09 0.00 -1.71 0.00 0.00 66.02 63.94 3i05 s SER 85 CO 0.00 0.14 1.23 0.23 1.20 0.00 0.00 173.24 176.04 3i05 n MET 86 N 0.45 1.75 -1.77 5.44 0.00 -1.26 -4.68 117.12 117.04 3i05 n MET 86 Ca -0.14 0.63 -0.31 0.00 0.00 0.00 0.00 57.70 57.88 3i05 n MET 86 Cb 0.55 -2.35 0.03 0.00 0.00 0.00 0.00 33.22 31.45 3i05 n MET 86 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 175.97 174.96 3i05 s HIS 87 N -1.25 3.36 0.12 2.03 0.09 -1.26 -2.20 115.29 116.19 3i05 s HIS 87 Ca 0.64 1.26 -0.23 0.00 -0.00 0.00 0.00 55.06 56.73 3i05 s HIS 87 Cb -0.49 -2.87 -0.06 0.00 -0.00 0.00 0.00 32.58 29.16 3i05 s HIS 87 CO 0.56 -1.03 1.68 0.52 -0.00 0.00 0.00 174.74 176.47 3i05 h MET 88 N -0.56 -0.22 0.00 1.40 2.86 -1.52 -1.83 114.93 115.07 3i05 h MET 88 Ca -0.44 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.21 3i05 h MET 88 Cb 1.21 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.92 3i05 h MET 88 CO 0.61 -0.14 0.34 0.78 1.06 0.00 0.00 176.91 179.56 3i05 h GLY 89 N -0.22 0.00 2.00 8.32 0.00 -1.93 -0.37 103.07 110.86 3i05 h GLY 89 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 3i05 h GLY 89 CO -0.16 0.00 0.00 1.42 0.00 0.00 0.00 176.54 177.80 3i05 n HIS 90 N -2.51 0.53 0.17 5.60 -0.00 -0.69 -3.80 115.22 114.52 3i05 n HIS 90 Ca -0.01 0.16 0.04 0.00 -0.00 0.00 0.00 57.72 57.91 3i05 n HIS 90 Cb 0.38 -0.76 0.21 0.00 -0.00 0.00 0.00 29.99 29.81 3i05 n HIS 90 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 3i05 h LEU 91 N 0.00 0.00 -0.19 2.41 4.07 -1.17 -3.39 115.31 117.04 3i05 h LEU 91 Ca 0.00 0.00 0.03 0.00 0.08 0.00 0.00 57.88 57.99 3i05 h LEU 91 Cb 0.59 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 42.27 3i05 h LEU 91 CO 0.00 0.45 -0.49 0.40 -1.08 0.00 0.00 178.44 177.72 3i05 h ILE 92 N 0.00 0.00 0.00 1.22 5.03 -1.76 0.27 117.51 122.27 3i05 h ILE 92 Ca -0.00 0.00 -0.01 0.00 -0.12 0.00 0.00 64.86 64.72 3i05 h ILE 92 Cb 1.11 0.00 -0.00 0.00 -3.03 0.00 0.00 36.82 34.90 3i05 h ILE 92 CO 0.06 0.00 -0.07 1.55 -0.68 0.00 0.00 178.15 179.01 3i05 h PRO 93 N -0.47 0.00 0.02 2.37 0.13 -1.88 -0.39 132.00 131.76 3i05 h PRO 93 Ca 0.04 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.97 3i05 h PRO 93 Cb 0.59 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.73 3i05 h PRO 93 CO -0.43 0.07 -0.77 0.74 -0.23 0.00 0.00 178.00 177.38 3i05 h PHE 94 N 0.00 0.74 -0.60 1.56 0.04 -1.36 -0.46 116.94 116.86 3i05 h PHE 94 Ca -0.00 -0.42 0.05 0.00 2.80 0.00 0.00 57.97 60.40 3i05 h PHE 94 Cb 0.19 -0.08 -0.05 0.00 2.20 0.00 0.00 35.95 38.21 3i05 h PHE 94 CO 0.00 1.25 0.33 0.52 -0.60 0.00 0.00 178.31 179.80 3i05 h MET 95 N 0.03 0.60 -0.03 1.51 2.86 0.29 0.90 114.93 121.08 3i05 h MET 95 Ca -0.10 -0.04 -0.08 0.00 -2.06 0.00 0.00 59.70 57.42 3i05 h MET 95 Cb 1.47 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 33.00 3i05 h MET 95 CO 0.15 0.40 -0.29 0.35 1.06 0.00 0.00 176.91 178.57 3i05 h PHE 96 N 0.62 0.36 -0.46 -0.22 3.57 -1.14 -2.52 116.94 117.14 3i05 h PHE 96 Ca 0.26 -0.17 0.09 0.00 3.53 0.00 0.00 57.97 61.69 3i05 h PHE 96 Cb 0.15 -0.05 -0.09 0.00 2.79 0.00 0.00 35.95 38.75 3i05 h PHE 96 CO -0.09 0.93 -0.14 1.15 -2.23 0.00 0.00 178.31 177.94 3i05 h THR 97 N -0.31 0.50 -0.94 4.41 2.02 -0.97 0.22 112.91 117.83 3i05 h THR 97 Ca -0.03 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.15 3i05 h THR 97 Cb 0.98 0.50 -0.05 0.00 -1.74 0.00 0.00 68.15 67.84 3i05 h THR 97 CO 0.06 0.00 0.60 0.50 0.37 0.00 0.00 175.52 177.05 3i05 h LYS 98 N -0.03 1.26 0.16 6.66 3.64 -0.83 0.60 116.57 128.04 3i05 h LYS 98 Ca 0.22 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.50 3i05 h LYS 98 Cb 0.37 -0.27 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 3i05 h LYS 98 CO -0.49 0.86 -0.08 2.35 -2.27 0.00 0.00 179.45 179.82 3i05 h TRP 99 N 1.29 -0.20 -0.69 1.91 7.01 -0.84 -0.46 115.95 123.97 3i05 h TRP 99 Ca 0.34 -0.00 0.11 0.00 2.11 0.00 0.00 58.89 61.45 3i05 h TRP 99 Cb -0.10 0.07 -0.08 0.00 -2.10 0.00 0.00 29.16 26.94 3i05 h TRP 99 CO -0.00 -0.05 0.29 -0.07 -2.79 0.00 0.00 178.44 175.82 3i05 h LEU 100 N -0.30 0.32 0.02 0.65 3.38 -0.07 0.98 115.31 120.29 3i05 h LEU 100 Ca -0.02 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3i05 h LEU 100 Cb 0.24 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3i05 h LEU 100 CO 0.04 0.16 -0.01 -0.61 0.09 0.00 0.00 178.44 178.11 3i05 h GLN 101 N 0.48 -0.02 -0.73 1.13 4.15 -0.78 0.85 115.11 120.19 3i05 h GLN 101 Ca 0.36 0.00 0.06 0.00 0.77 0.00 0.00 58.65 59.84 3i05 h GLN 101 Cb 0.46 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.10 3i05 h GLN 101 CO -0.33 0.19 0.43 -0.44 -1.93 0.00 0.00 178.83 176.75 3i05 h ASP 102 N -0.23 0.66 0.43 -0.69 5.19 -0.64 -0.05 116.42 121.10 3i05 h ASP 102 Ca -0.00 0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.41 3i05 h ASP 102 Cb 0.22 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 39.62 3i05 h ASP 102 CO 0.00 0.43 -0.21 0.28 -3.12 0.00 0.00 179.24 176.62 3i05 h SER 103 N 0.80 -0.49 0.93 6.45 0.02 -0.55 -3.32 113.55 117.38 3i05 h SER 103 Ca 0.32 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 3i05 h SER 103 Cb 0.16 0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.83 3i05 h SER 103 CO -0.17 -0.12 0.00 0.49 -1.14 0.00 0.00 176.83 175.89 3i05 n PHE 104 N -4.87 0.00 -3.40 3.45 3.01 0.27 -4.93 117.46 110.99 3i05 n PHE 104 Ca -0.07 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.22 3i05 n PHE 104 Cb 0.23 -0.49 0.09 0.00 -0.01 0.00 0.00 39.48 39.30 3i05 n PHE 104 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 3i05 n ARG 105 N -1.49 -6.44 -4.44 -1.08 3.00 -0.04 -5.02 116.66 101.16 3i05 n ARG 105 Ca 0.07 0.83 -0.25 0.00 -0.00 0.00 0.00 57.85 58.50 3i05 n ARG 105 Cb 0.32 -5.79 -0.10 0.00 0.00 0.00 0.00 32.46 26.88 3i05 n ARG 105 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 3i05 s VAL 106 N -3.35 2.50 0.59 5.15 -7.23 -1.18 -5.05 120.40 111.83 3i05 s VAL 106 Ca 0.00 -2.25 -0.17 0.00 -1.81 0.00 0.00 61.98 57.75 3i05 s VAL 106 Cb -0.00 -2.28 -0.03 0.00 0.56 0.00 0.00 36.38 34.63 3i05 s VAL 106 CO 0.71 -0.30 1.11 -2.84 -0.31 0.00 0.00 175.10 173.47 3i05 s PRO 107 N -3.24 3.15 -0.06 4.82 0.02 -1.26 -4.75 135.00 133.69 3i05 s PRO 107 Ca 0.27 1.45 0.02 0.00 0.02 0.00 0.00 61.00 62.75 3i05 s PRO 107 Cb -0.06 -1.99 0.02 0.00 0.02 0.00 0.00 34.50 32.48 3i05 s PRO 107 CO 0.14 -0.98 -0.09 -1.17 -0.33 0.00 0.00 177.00 174.57 3i05 s LEU 108 N -4.31 1.49 -0.24 -5.54 2.96 -0.01 -0.99 118.68 112.03 3i05 s LEU 108 Ca 0.69 -0.23 -0.04 0.00 -0.22 0.00 0.00 54.13 54.32 3i05 s LEU 108 Cb -0.21 -0.68 0.00 0.00 0.50 0.00 0.00 46.19 45.80 3i05 s LEU 108 CO 0.34 -0.01 -0.03 0.54 -1.32 0.00 0.00 176.35 175.87 3i05 s VAL 109 N 0.84 3.38 -0.26 1.68 0.11 -0.06 -0.94 120.40 125.16 3i05 s VAL 109 Ca -0.12 -0.62 -0.05 0.00 -2.93 0.00 0.00 61.98 58.26 3i05 s VAL 109 Cb -0.15 -2.60 -0.00 0.00 -1.53 0.00 0.00 36.38 32.10 3i05 s VAL 109 CO 0.01 0.33 0.02 -0.63 -3.33 0.00 0.00 175.10 171.51 3i05 s ILE 110 N 1.46 3.69 -0.20 7.04 1.01 0.22 -2.16 121.20 132.26 3i05 s ILE 110 Ca 0.04 -0.59 -0.17 0.00 0.00 0.00 0.00 60.65 59.93 3i05 s ILE 110 Cb -0.15 -2.81 -0.04 0.00 0.01 0.00 0.00 42.46 39.47 3i05 s ILE 110 CO -0.03 0.24 0.43 -1.58 0.00 0.00 0.00 174.94 174.00 3i05 s GLN 111 N 1.49 4.19 -0.44 2.79 0.74 -0.82 -0.76 119.66 126.85 3i05 s GLN 111 Ca 0.04 0.26 -0.16 0.00 0.05 0.00 0.00 55.36 55.55 3i05 s GLN 111 Cb -0.16 -3.53 0.04 0.00 1.10 0.00 0.00 33.01 30.46 3i05 s GLN 111 CO -0.00 -0.05 0.36 -1.64 -0.55 0.00 0.00 175.29 173.41 3i05 s MET 112 N 1.33 2.99 -1.52 1.67 -1.94 0.57 -0.51 119.30 121.88 3i05 s MET 112 Ca 0.20 -1.13 -0.10 0.00 -1.71 0.00 0.00 55.69 52.96 3i05 s MET 112 Cb -0.15 -4.04 -0.01 0.00 2.01 0.00 0.00 34.83 32.64 3i05 s MET 112 CO 0.08 -0.88 2.64 0.25 -0.01 0.00 0.00 175.02 177.10 3i05 n THR 113 N 5.22 4.27 -0.21 2.05 -2.24 -1.08 -2.44 114.28 119.85 3i05 n THR 113 Ca -0.11 -3.06 -0.09 0.00 -2.27 0.00 0.00 64.05 58.52 3i05 n THR 113 Cb 0.46 -2.52 0.02 0.00 -2.10 0.00 0.00 70.33 66.19 3i05 n THR 113 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 3i05 h ASP 114 N 5.22 1.06 -0.67 3.42 3.04 -1.93 -2.42 116.42 124.15 3i05 h ASP 114 Ca 0.75 -0.32 0.04 0.00 -3.24 0.00 0.00 57.03 54.26 3i05 h ASP 114 Cb 0.39 -0.29 -0.04 0.00 -1.04 0.00 0.00 39.33 38.35 3i05 h ASP 114 CO 1.76 1.13 0.44 -2.24 -2.04 0.00 0.00 179.24 178.28 3i05 h ASP 115 N 0.97 0.65 -0.35 4.15 2.03 -1.94 -2.24 116.42 119.69 3i05 h ASP 115 Ca 0.17 -0.00 -0.05 0.00 -0.73 0.00 0.00 57.03 56.41 3i05 h ASP 115 Cb 0.60 -0.15 -0.01 0.00 -0.83 0.00 0.00 39.33 38.94 3i05 h ASP 115 CO 0.04 0.44 0.02 -0.08 -1.03 0.00 0.00 179.24 178.62 3i05 h GLU 116 N 0.76 0.62 -0.57 4.15 4.22 -1.82 -0.75 114.58 121.18 3i05 h GLU 116 Ca 0.27 -0.19 -0.01 0.00 0.08 0.00 0.00 59.36 59.51 3i05 h GLU 116 Cb 0.14 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.30 3i05 h GLU 116 CO -0.08 0.72 0.30 -0.22 -2.18 0.00 0.00 179.01 177.55 3i05 h LYS 117 N 0.43 0.80 -0.78 1.92 1.63 -1.27 -1.32 116.57 117.99 3i05 h LYS 117 Ca 0.10 -0.10 0.04 0.00 -0.85 0.00 0.00 60.65 59.85 3i05 h LYS 117 Cb 0.43 -0.15 -0.05 0.00 -0.60 0.00 0.00 32.23 31.86 3i05 h LYS 117 CO 0.02 0.62 0.49 0.35 -3.45 0.00 0.00 179.45 177.47 3i05 h PHE 118 N 0.76 0.91 0.00 1.91 3.57 -1.22 -1.99 116.94 120.88 3i05 h PHE 118 Ca 0.20 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.61 3i05 h PHE 118 Cb 0.06 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 38.49 3i05 h PHE 118 CO -0.01 0.50 -0.55 1.88 -2.23 0.00 0.00 178.31 177.90 3i05 h TYR 119 N 0.93 0.00 0.00 0.41 0.05 -0.73 -3.39 116.97 114.25 3i05 h TYR 119 Ca 0.32 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.98 3i05 h TYR 119 Cb 0.07 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.79 3i05 h TYR 119 CO -0.04 0.55 -0.82 0.35 -1.05 0.00 0.00 178.16 177.16 3i05 h PHE 120 N 0.00 0.00 -3.32 4.88 3.57 -1.00 -3.43 116.94 117.64 3i05 h PHE 120 Ca -0.01 0.00 -0.52 0.00 3.53 0.00 0.00 57.97 60.97 3i05 h PHE 120 Cb 1.27 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 40.00 3i05 h PHE 120 CO 0.00 0.88 -0.11 1.03 -2.23 0.00 0.00 178.31 177.88 3i05 s ARG 121 N -2.25 3.70 -1.24 1.11 1.81 -0.77 -5.01 118.95 116.29 3i05 s ARG 121 Ca -0.21 0.13 -0.15 0.00 -1.72 0.00 0.00 55.73 53.77 3i05 s ARG 121 Cb 0.03 -2.63 0.14 0.00 -0.45 0.00 0.00 34.95 32.04 3i05 s ARG 121 CO 0.44 0.23 1.54 1.21 -0.68 0.00 0.00 175.30 178.04 3i05 s ASN 122 N -2.90 6.99 0.08 0.23 3.84 -1.26 -4.60 114.94 117.32 3i05 s ASN 122 Ca 0.46 -2.80 0.10 0.00 0.21 0.00 0.00 52.86 50.82 3i05 s ASN 122 Cb -0.11 -2.46 -0.03 0.00 -0.55 0.00 0.00 41.25 38.10 3i05 s ASN 122 CO 0.27 -0.89 -0.26 -0.63 -2.79 0.00 0.00 177.10 172.80 3i05 s ILE 123 N 2.49 2.12 0.15 -5.21 1.01 -1.26 -5.12 121.20 115.38 3i05 s ILE 123 Ca 0.47 -1.52 -0.30 0.00 0.00 0.00 0.00 60.65 59.29 3i05 s ILE 123 Cb -0.00 -1.84 -0.08 0.00 0.01 0.00 0.00 42.46 40.54 3i05 s ILE 123 CO 0.03 0.22 1.29 -2.84 0.00 0.00 0.00 174.94 173.63 3i05 s PRO 124 N -1.59 4.40 0.34 2.79 0.02 -1.26 -4.90 135.00 134.80 3i05 s PRO 124 Ca 0.12 1.97 0.15 0.00 0.02 0.00 0.00 61.00 63.26 3i05 s PRO 124 Cb -0.10 -3.25 1.10 0.00 0.02 0.00 0.00 34.50 32.28 3i05 s PRO 124 CO 0.04 -0.27 1.65 1.98 -0.33 0.00 0.00 177.00 180.07 3i05 h MET 125 N 5.98 0.28 0.00 5.54 4.05 -1.99 0.26 114.93 129.05 3i05 h MET 125 Ca -0.43 -0.02 -0.04 0.00 -0.28 0.00 0.00 59.70 58.93 3i05 h MET 125 Cb 1.21 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.95 3i05 h MET 125 CO 0.80 0.18 -0.18 1.49 0.23 0.00 0.00 176.91 179.43 3i05 h GLU 126 N 0.28 0.00 0.00 0.39 4.57 -1.99 -0.27 114.58 117.57 3i05 h GLU 126 Ca 0.74 0.00 -0.26 0.00 -1.18 0.00 0.00 59.36 58.66 3i05 h GLU 126 Cb 1.71 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 30.33 3i05 h GLU 126 CO -0.63 0.18 -1.03 0.37 -1.18 0.00 0.00 179.01 176.73 3i05 h GLN 127 N 0.00 0.69 -0.31 1.92 4.15 -0.86 -2.48 115.11 118.21 3i05 h GLN 127 Ca -0.00 -0.75 -0.00 0.00 0.77 0.00 0.00 58.65 58.67 3i05 h GLN 127 Cb 0.66 0.21 -0.01 0.00 0.21 0.00 0.00 27.48 28.55 3i05 h GLN 127 CO 0.02 1.32 0.18 0.28 -1.93 0.00 0.00 178.83 178.70 3i05 h VAL 128 N 0.36 1.12 -0.41 2.39 2.07 -1.24 -1.82 116.25 118.72 3i05 h VAL 128 Ca -0.13 -0.30 -0.06 0.00 0.82 0.00 0.00 66.70 67.03 3i05 h VAL 128 Cb 1.68 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.20 3i05 h VAL 128 CO 0.20 0.12 0.00 -0.08 0.02 0.00 0.00 177.57 177.83 3i05 h GLU 129 N 0.39 0.65 -0.30 1.57 4.81 -1.11 0.20 114.58 120.79 3i05 h GLU 129 Ca 0.11 -0.16 -0.16 0.00 -0.13 0.00 0.00 59.36 59.02 3i05 h GLU 129 Cb 0.04 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.33 3i05 h GLU 129 CO -0.02 0.67 -0.45 0.00 -0.73 0.00 0.00 179.01 178.48 3i05 h ALA 130 N 1.39 0.46 -0.21 2.92 0.00 -1.35 -1.98 119.26 120.48 3i05 h ALA 130 Ca 0.13 -0.48 -0.18 0.00 0.00 0.00 0.00 54.91 54.38 3i05 h ALA 130 Cb 0.38 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 3i05 h ALA 130 CO 0.01 0.60 -0.59 0.00 0.00 0.00 0.00 179.25 179.28 3i05 h MET 131 N 0.61 0.69 -0.35 0.00 -0.00 -0.88 -2.95 114.93 112.04 3i05 h MET 131 Ca 0.03 -0.45 0.05 0.00 -0.00 0.00 0.00 59.70 59.32 3i05 h MET 131 Cb 1.05 0.06 -0.05 0.00 -0.00 0.00 0.00 31.60 32.67 3i05 h MET 131 CO 0.10 1.07 0.08 1.15 -0.00 0.00 0.00 176.91 179.31 3i05 h THR 132 N 0.52 0.84 -0.75 -0.10 2.02 -0.57 0.70 112.91 115.57 3i05 h THR 132 Ca 0.00 -0.07 0.17 0.00 0.77 0.00 0.00 66.41 67.28 3i05 h THR 132 Cb 1.16 0.62 -0.11 0.00 -1.74 0.00 0.00 68.15 68.08 3i05 h THR 132 CO 0.12 0.04 0.18 0.74 0.37 0.00 0.00 175.52 176.97 3i05 h THR 133 N 0.20 0.50 -0.40 3.16 2.02 -1.24 0.15 112.91 117.29 3i05 h THR 133 Ca 0.16 -0.09 -0.14 0.00 0.77 0.00 0.00 66.41 67.11 3i05 h THR 133 Cb 0.18 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 3i05 h THR 133 CO -0.21 0.05 -0.31 -0.33 0.37 0.00 0.00 175.52 175.09 3i05 h GLU 134 N 0.27 0.89 -0.42 6.66 4.39 -0.98 -2.18 114.58 123.21 3i05 h GLU 134 Ca 0.43 -0.42 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 3i05 h GLU 134 Cb 0.74 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.36 3i05 h GLU 134 CO -0.52 1.07 0.12 -0.91 -1.16 0.00 0.00 179.01 177.61 3i05 h ASN 135 N 0.75 0.56 -0.83 1.42 -0.26 0.46 -2.27 115.58 115.40 3i05 h ASN 135 Ca 0.08 -0.07 -0.04 0.00 -0.56 0.00 0.00 56.30 55.71 3i05 h ASN 135 Cb 0.88 -0.14 -0.04 0.00 -1.06 0.00 0.00 38.32 37.95 3i05 h ASN 135 CO 0.08 0.55 0.37 0.40 -1.06 0.00 0.00 177.43 177.77 3i05 h ILE 136 N 0.60 1.26 -0.66 2.81 2.04 -0.23 -2.63 117.51 120.69 3i05 h ILE 136 Ca 0.14 -0.76 -0.04 0.00 1.00 0.00 0.00 64.86 65.20 3i05 h ILE 136 Cb 0.20 0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 36.48 3i05 h ILE 136 CO -0.01 0.32 0.26 0.11 0.00 0.00 0.00 178.15 178.84 3i05 h LYS 137 N 1.18 0.99 -0.99 2.37 1.57 -0.94 -1.38 116.57 119.37 3i05 h LYS 137 Ca 0.28 -0.18 0.09 0.00 -1.87 0.00 0.00 60.65 58.97 3i05 h LYS 137 Cb 0.15 -0.16 -0.08 0.00 0.08 0.00 0.00 32.23 32.23 3i05 h LYS 137 CO -0.03 0.83 0.62 -0.44 -0.57 0.00 0.00 179.45 179.86 3i05 h ASP 138 N 0.93 0.96 0.16 0.86 3.45 -1.12 -1.23 116.42 120.43 3i05 h ASP 138 Ca 0.22 0.03 -0.01 0.00 0.43 0.00 0.00 57.03 57.70 3i05 h ASP 138 Cb 0.21 -0.17 0.00 0.00 -0.56 0.00 0.00 39.33 38.81 3i05 h ASP 138 CO -0.02 0.56 -0.08 0.40 -1.57 0.00 0.00 179.24 178.54 3i05 h ILE 139 N 1.06 0.96 -0.78 0.35 5.03 -1.11 -3.19 117.51 119.84 3i05 h ILE 139 Ca 0.46 -0.91 0.17 0.00 -0.12 0.00 0.00 64.86 64.45 3i05 h ILE 139 Cb 0.32 1.48 -0.05 0.00 -3.03 0.00 0.00 36.82 35.54 3i05 h ILE 139 CO -0.22 0.20 0.52 0.40 -0.68 0.00 0.00 178.15 178.37 3i05 h ILE 140 N -0.69 0.74 0.00 -0.67 2.04 -1.05 0.15 117.51 118.02 3i05 h ILE 140 Ca -0.02 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.72 3i05 h ILE 140 Cb 0.50 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 3i05 h ILE 140 CO 0.04 0.06 0.00 0.00 0.00 0.00 0.00 178.15 178.25 3i05 n ALA 141 N -2.55 1.49 0.74 1.87 0.00 -0.48 -2.12 120.51 119.47 3i05 n ALA 141 Ca 0.15 -0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.70 3i05 n ALA 141 Cb 0.61 -1.22 0.47 0.00 0.00 0.00 0.00 19.45 19.31 3i05 n ALA 141 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3i05 n MET 142 N -1.67 0.02 -0.07 0.00 2.81 0.51 -4.71 117.12 114.00 3i05 n MET 142 Ca 0.02 0.13 0.00 0.00 -1.81 0.00 0.00 57.70 56.05 3i05 n MET 142 Cb 0.14 -1.53 0.00 0.00 -0.71 0.00 0.00 33.22 31.12 3i05 n MET 142 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3i05 n GLY 143 N 0.78 0.96 3.74 3.03 0.00 -0.90 -5.05 105.19 107.74 3i05 n GLY 143 Ca 0.05 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 3i05 n GLY 143 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3i05 n PHE 144 N -2.07 2.73 -2.42 1.61 3.01 -1.26 -4.90 117.46 114.16 3i05 n PHE 144 Ca 0.00 0.39 -0.43 0.00 1.01 0.00 0.00 57.45 58.42 3i05 n PHE 144 Cb 0.00 -2.53 -0.02 0.00 -0.01 0.00 0.00 39.48 36.92 3i05 n PHE 144 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 3i05 s ASP 145 N 0.12 6.57 0.00 4.37 -1.08 -1.26 -4.90 116.67 120.49 3i05 s ASP 145 Ca 0.59 1.03 0.09 0.00 -0.52 0.00 0.00 52.55 53.74 3i05 s ASP 145 Cb -0.52 -2.54 0.40 0.00 -1.46 0.00 0.00 42.92 38.80 3i05 s ASP 145 CO 0.56 -1.20 1.28 -0.81 0.52 0.00 0.00 175.17 175.52 3i05 n PRO 146 N 7.59 0.02 0.18 4.34 -0.04 -1.26 -1.32 135.00 144.51 3i05 n PRO 146 Ca 0.15 0.32 0.03 0.00 -0.04 0.00 0.00 63.50 63.97 3i05 n PRO 146 Cb 0.47 -1.50 0.34 0.00 -0.04 0.00 0.00 33.50 32.77 3i05 n PRO 146 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3i05 h GLU 147 N 0.00 0.00 0.00 0.54 4.57 -2.01 -3.35 114.58 114.34 3i05 h GLU 147 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3i05 h GLU 147 Cb 0.15 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.74 3i05 h GLU 147 CO 0.00 0.41 -0.20 1.28 -1.18 0.00 0.00 179.01 179.32 3i05 n LEU 148 N -3.81 1.22 -3.94 1.64 4.77 -0.43 -4.53 117.00 111.93 3i05 n LEU 148 Ca -0.01 -1.97 -0.20 0.00 -0.03 0.00 0.00 56.01 53.80 3i05 n LEU 148 Cb 0.48 -0.20 -0.16 0.00 -2.33 0.00 0.00 43.42 41.21 3i05 n LEU 148 CO 0.38 0.46 -0.42 0.28 -1.33 0.00 0.00 177.39 176.76 3i05 s THR 149 N -1.39 0.67 -0.29 -5.08 -1.32 -0.70 -0.83 115.64 106.69 3i05 s THR 149 Ca 0.15 -0.23 0.01 0.00 -1.21 0.00 0.00 61.69 60.41 3i05 s THR 149 Cb 0.13 -0.65 0.09 0.00 -1.51 0.00 0.00 72.50 70.55 3i05 s THR 149 CO 0.01 0.24 0.04 0.12 -2.21 0.00 0.00 174.62 172.82 3i05 s PHE 150 N 0.67 2.45 -0.15 9.09 5.36 -0.11 -4.73 117.98 130.56 3i05 s PHE 150 Ca -0.10 -2.05 -0.16 0.00 -0.96 0.00 0.00 56.93 53.66 3i05 s PHE 150 Cb -0.13 -1.97 -0.04 0.00 -0.34 0.00 0.00 43.02 40.53 3i05 s PHE 150 CO 0.01 -0.85 0.39 0.42 -1.46 0.00 0.00 175.22 173.72 3i05 s ILE 151 N 1.36 5.24 0.05 3.12 1.01 -1.05 -0.61 121.20 130.33 3i05 s ILE 151 Ca 0.05 0.75 0.04 0.00 0.00 0.00 0.00 60.65 61.49 3i05 s ILE 151 Cb -0.18 -3.73 -0.03 0.00 0.01 0.00 0.00 42.46 38.54 3i05 s ILE 151 CO -0.14 0.34 -0.13 0.72 0.00 0.00 0.00 174.94 175.73 3i05 s PHE 152 N 0.70 1.10 -0.16 3.97 -0.71 0.06 -3.90 117.98 119.05 3i05 s PHE 152 Ca 0.21 -0.42 -0.17 0.00 -1.04 0.00 0.00 56.93 55.51 3i05 s PHE 152 Cb -0.14 -0.64 -0.04 0.00 -1.21 0.00 0.00 43.02 40.99 3i05 s PHE 152 CO 0.07 0.03 0.42 1.03 -1.34 0.00 0.00 175.22 175.42 3i05 s ARG 153 N -1.47 4.27 0.26 1.99 0.52 -1.26 -0.31 118.95 122.94 3i05 s ARG 153 Ca -0.02 0.30 -0.02 0.00 -0.52 0.00 0.00 55.73 55.46 3i05 s ARG 153 Cb -0.09 -3.47 0.46 0.00 0.52 0.00 0.00 34.95 32.37 3i05 s ARG 153 CO 0.02 0.10 1.81 -0.44 0.02 0.00 0.00 175.30 176.80 3i05 h ASP 154 N 6.94 0.70 -0.24 0.23 3.32 -1.87 0.12 116.42 125.62 3i05 h ASP 154 Ca -0.39 0.06 0.07 0.00 0.02 0.00 0.00 57.03 56.78 3i05 h ASP 154 Cb 1.17 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.63 3i05 h ASP 154 CO 0.75 0.38 0.17 -0.26 -1.72 0.00 0.00 179.24 178.56 3i05 h PHE 155 N 0.80 0.00 0.03 4.55 0.04 -1.94 0.41 116.94 120.84 3i05 h PHE 155 Ca 0.43 0.00 -0.38 0.00 2.80 0.00 0.00 57.97 60.82 3i05 h PHE 155 Cb 0.45 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.54 3i05 h PHE 155 CO -0.05 0.00 -2.34 -0.25 -0.60 0.00 0.00 178.31 175.06 3i05 n ASP 156 N -4.42 1.73 0.09 2.17 8.00 -0.51 -4.62 116.55 118.99 3i05 n ASP 156 Ca 0.03 -0.03 0.11 0.00 0.71 0.00 0.00 54.79 55.60 3i05 n ASP 156 Cb 0.32 -0.32 -0.01 0.00 -0.02 0.00 0.00 41.12 41.09 3i05 n ASP 156 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3i05 n TYR 157 N -3.23 0.91 -1.67 1.24 9.36 0.30 -4.70 117.16 119.36 3i05 n TYR 157 Ca -0.41 0.27 -0.42 0.00 3.32 0.00 0.00 57.90 60.66 3i05 n TYR 157 Cb 1.02 -0.94 -0.00 0.00 -0.63 0.00 0.00 39.34 38.80 3i05 n TYR 157 CO 0.00 0.00 0.00 -0.12 0.22 0.00 0.00 176.86 176.96 3i05 n MET 158 N -2.66 1.87 0.00 2.98 1.56 0.12 -1.75 117.12 119.24 3i05 n MET 158 Ca -0.01 0.66 0.00 0.00 -0.27 0.00 0.00 57.70 58.08 3i05 n MET 158 Cb 0.56 -2.24 0.00 0.00 2.15 0.00 0.00 33.22 33.70 3i05 n MET 158 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 3i05 n GLY 159 N 0.89 2.95 0.17 -5.12 0.00 -1.26 -4.70 105.19 98.12 3i05 n GLY 159 Ca 0.06 -0.77 -0.05 0.00 0.00 0.00 0.00 46.02 45.26 3i05 n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i05 n MET 161 N -5.09 2.32 -0.10 0.00 0.00 -1.11 -4.69 117.12 108.45 3i05 n MET 161 Ca 0.03 -2.09 0.23 0.00 0.00 0.00 0.00 57.70 55.86 3i05 n MET 161 Cb 0.18 -1.40 0.67 0.00 0.00 0.00 0.00 33.22 32.67 3i05 n MET 161 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 175.97 175.05 3i05 h TYR 162 N 3.35 0.08 -0.49 3.17 3.20 -1.84 -1.19 116.97 123.26 3i05 h TYR 162 Ca 0.00 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.79 3i05 h TYR 162 Cb 0.83 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 39.05 3i05 h TYR 162 CO 0.24 0.03 -0.02 0.00 -1.64 0.00 0.00 178.16 176.77 3i05 h ARG 163 N 0.07 0.88 -0.15 1.82 3.08 -1.85 0.43 114.38 118.66 3i05 h ARG 163 Ca 0.34 -0.29 -0.17 0.00 0.07 0.00 0.00 59.98 59.93 3i05 h ARG 163 Cb 1.25 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 31.22 3i05 h ARG 163 CO -0.03 0.93 -0.62 0.00 -1.07 0.00 0.00 179.97 179.19 3i05 h THR 164 N 0.74 1.33 -0.51 2.04 1.03 -1.60 -2.25 112.91 113.70 3i05 h THR 164 Ca 0.14 -1.90 0.01 0.00 -0.01 0.00 0.00 66.41 64.65 3i05 h THR 164 Cb 0.54 1.88 -0.03 0.00 -1.07 0.00 0.00 68.15 69.47 3i05 h THR 164 CO 0.03 0.59 0.32 0.58 -0.01 0.00 0.00 175.52 177.02 3i05 h VAL 165 N 0.40 1.09 -0.56 0.00 2.07 -1.03 -2.55 116.25 115.67 3i05 h VAL 165 Ca -0.01 -0.22 0.02 0.00 0.82 0.00 0.00 66.70 67.31 3i05 h VAL 165 Cb 1.17 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 3i05 h VAL 165 CO 0.11 0.12 0.37 0.00 0.02 0.00 0.00 177.57 178.19 3i05 h ALA 166 N 1.20 1.65 0.00 1.67 0.00 0.09 -0.25 119.26 123.62 3i05 h ALA 166 Ca 0.19 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 3i05 h ALA 166 Cb -0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 3i05 h ALA 166 CO -0.07 0.31 -0.42 0.87 0.00 0.00 0.00 179.25 179.94 3i05 h LYS 167 N 0.71 0.00 0.09 0.00 1.57 -0.99 -1.86 116.57 116.08 3i05 h LYS 167 Ca 0.22 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.79 3i05 h LYS 167 Cb -0.01 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.30 3i05 h LYS 167 CO -0.05 0.42 -1.02 0.82 -0.57 0.00 0.00 179.45 179.05 3i05 h ILE 168 N 0.00 1.26 -0.62 1.86 2.04 -1.09 -2.87 117.51 118.10 3i05 h ILE 168 Ca -0.00 -2.40 0.12 0.00 1.00 0.00 0.00 64.86 63.57 3i05 h ILE 168 Cb 0.81 2.89 -0.09 0.00 -0.74 0.00 0.00 36.82 39.68 3i05 h ILE 168 CO 0.06 0.64 0.12 -0.33 0.00 0.00 0.00 178.15 178.64 3i05 h GLU 169 N -0.52 0.24 0.00 2.37 4.39 -1.05 0.18 114.58 120.20 3i05 h GLU 169 Ca -0.22 -0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.42 3i05 h GLU 169 Cb 1.56 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 30.15 3i05 h GLU 169 CO 0.04 0.16 -0.20 -0.09 -1.16 0.00 0.00 179.01 177.76 3i05 h ARG 170 N 0.25 0.00 0.14 2.33 2.43 -1.43 -3.07 114.38 115.03 3i05 h ARG 170 Ca 0.33 0.00 -0.28 0.00 -0.81 0.00 0.00 59.98 59.22 3i05 h ARG 170 Cb 0.51 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.07 3i05 h ARG 170 CO -0.43 0.20 -1.25 0.00 -1.51 0.00 0.00 179.97 176.98 3i05 h ALA 171 N 1.80 0.07 -2.74 2.80 0.00 -0.52 -3.45 119.26 117.22 3i05 h ALA 171 Ca -0.00 -0.85 -0.49 0.00 0.00 0.00 0.00 54.91 53.57 3i05 h ALA 171 Cb 0.42 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3i05 h ALA 171 CO 0.03 0.87 0.34 -0.06 0.00 0.00 0.00 179.25 180.43 3i05 s PHE 172 N -2.75 3.98 0.10 0.00 0.08 0.17 -5.08 117.98 114.47 3i05 s PHE 172 Ca -0.06 1.90 0.02 0.00 0.12 0.00 0.00 56.93 58.91 3i05 s PHE 172 Cb 0.07 -2.97 -0.04 0.00 -0.57 0.00 0.00 43.02 39.51 3i05 s PHE 172 CO 0.90 0.45 0.17 0.95 -0.10 0.00 0.00 175.22 177.59 3i05 s THR 173 N -1.11 4.93 0.22 0.64 -4.23 -1.26 -4.88 115.64 109.94 3i05 s THR 173 Ca 0.41 -0.70 -0.08 0.00 -1.18 0.00 0.00 61.69 60.14 3i05 s THR 173 Cb -0.26 -3.44 0.16 0.00 1.34 0.00 0.00 72.50 70.30 3i05 s THR 173 CO 0.32 0.04 1.77 0.00 -0.54 0.00 0.00 174.62 176.21 3i05 h ALA 174 N 2.83 0.91 -0.60 3.99 0.00 -1.98 0.24 119.26 124.65 3i05 h ALA 174 Ca -0.47 0.05 0.12 0.00 0.00 0.00 0.00 54.91 54.62 3i05 h ALA 174 Cb 1.18 -0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.83 3i05 h ALA 174 CO 0.69 -0.07 0.01 1.03 0.00 0.00 0.00 179.25 180.90 3i05 h SER 175 N 0.56 -0.26 0.18 0.00 0.87 -1.99 -0.77 113.55 112.15 3i05 h SER 175 Ca 0.33 0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 61.03 3i05 h SER 175 Cb 0.34 0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 3i05 h SER 175 CO -0.26 -0.10 -0.09 1.56 -0.53 0.00 0.00 176.83 177.41 3i05 h GLN 176 N 0.12 -0.23 -0.53 2.24 4.20 -1.38 -0.65 115.11 118.88 3i05 h GLN 176 Ca 0.31 0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.99 3i05 h GLN 176 Cb 0.50 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 3i05 h GLN 176 CO -0.51 0.04 0.12 -0.39 -0.67 0.00 0.00 178.83 177.41 3i05 h VAL 177 N -0.49 1.22 -0.41 -0.54 -1.51 -1.32 0.11 116.25 113.31 3i05 h VAL 177 Ca -0.02 -0.81 0.08 0.00 -1.23 0.00 0.00 66.70 64.71 3i05 h VAL 177 Cb 0.38 0.69 -0.07 0.00 -2.13 0.00 0.00 31.29 30.16 3i05 h VAL 177 CO 0.04 0.30 -0.06 -0.09 -1.23 0.00 0.00 177.57 176.53 3i05 h ARG 178 N 0.78 0.04 -0.53 5.19 2.43 -0.99 0.06 114.38 121.36 3i05 h ARG 178 Ca 0.17 -0.00 0.08 0.00 -0.81 0.00 0.00 59.98 59.42 3i05 h ARG 178 Cb 0.30 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.77 3i05 h ARG 178 CO -0.00 0.03 0.16 0.78 -1.51 0.00 0.00 179.97 179.42 3i05 h GLY 179 N 0.04 0.70 0.34 2.80 0.00 0.79 0.52 103.07 108.26 3i05 h GLY 179 Ca 0.20 -0.07 -0.02 0.00 0.00 0.00 0.00 47.33 47.44 3i05 h GLY 179 CO -0.38 -0.04 -0.16 0.00 0.00 0.00 0.00 176.54 175.96 3i05 n PHE 181 N -5.07 0.07 -2.77 0.00 3.01 -0.01 -4.96 117.46 107.73 3i05 n PHE 181 Ca -0.06 0.02 -0.13 0.00 1.01 0.00 0.00 57.45 58.29 3i05 n PHE 181 Cb 0.18 -0.30 0.03 0.00 -0.01 0.00 0.00 39.48 39.37 3i05 n PHE 181 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3i05 n GLY 182 N 1.48 -0.00 3.75 1.37 0.00 0.18 -4.98 105.19 106.98 3i05 n GLY 182 Ca 0.05 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 3i05 n GLY 182 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3i05 s PHE 183 N -2.95 3.45 0.43 1.61 0.08 -1.25 -5.04 117.98 114.32 3i05 s PHE 183 Ca 0.20 1.53 -0.07 0.00 0.12 0.00 0.00 56.93 58.72 3i05 s PHE 183 Cb -0.09 -3.40 -0.05 0.00 -0.57 0.00 0.00 43.02 38.92 3i05 s PHE 183 CO 0.25 -1.01 0.75 0.00 -0.10 0.00 0.00 175.22 175.11 3i05 s ALA 184 N -0.61 3.42 0.47 5.36 0.00 -1.26 -4.87 121.76 124.27 3i05 s ALA 184 Ca 0.49 -0.43 0.17 0.00 0.00 0.00 0.00 51.96 52.19 3i05 s ALA 184 Cb -0.33 -2.58 1.18 0.00 0.00 0.00 0.00 23.12 21.39 3i05 s ALA 184 CO 0.40 -0.17 2.06 0.52 0.00 0.00 0.00 175.76 178.57 3i05 h MET 185 N 0.72 0.00 0.00 0.00 2.86 -2.02 -1.43 114.93 115.06 3i05 h MET 185 Ca -0.47 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.17 3i05 h MET 185 Cb 1.20 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.86 3i05 h MET 185 CO 0.63 0.12 0.00 0.39 1.06 0.00 0.00 176.91 179.10 3i05 n GLU 186 N -4.27 0.09 -2.44 1.72 4.71 -1.26 -4.76 120.64 114.42 3i05 n GLU 186 Ca -0.03 0.05 -0.38 0.00 -0.01 0.00 0.00 57.16 56.79 3i05 n GLU 186 Cb 0.19 -1.50 -0.03 0.00 -1.01 0.00 0.00 31.44 29.09 3i05 n GLU 186 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 3i05 s ASP 187 N -2.90 6.84 0.61 1.62 1.01 -0.54 -5.01 116.67 118.30 3i05 s ASP 187 Ca 0.15 2.21 -0.15 0.00 0.71 0.00 0.00 52.55 55.47 3i05 s ASP 187 Cb 0.17 -2.61 -0.03 0.00 1.01 0.00 0.00 42.92 41.47 3i05 s ASP 187 CO 0.45 -0.44 1.06 0.54 0.21 0.00 0.00 175.17 176.99 3i05 s ASN 188 N -1.21 5.68 0.56 0.27 2.20 -1.26 -4.91 114.94 116.27 3i05 s ASN 188 Ca 0.53 1.81 0.25 0.00 -0.94 0.00 0.00 52.86 54.51 3i05 s ASN 188 Cb -0.28 -2.53 1.55 0.00 -2.00 0.00 0.00 41.25 37.99 3i05 s ASN 188 CO 0.35 -1.24 2.15 0.00 -2.94 0.00 0.00 177.10 175.42 3i05 h GLY 190 N 0.00 0.47 1.00 0.00 0.00 -1.93 -2.19 103.07 100.42 3i05 h GLY 190 Ca 0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.30 3i05 h GLY 190 CO -0.00 0.04 0.37 3.21 0.00 0.00 0.00 176.54 180.16 3i05 h ARG 191 N 0.30 0.85 -0.58 4.80 3.08 -1.50 -2.26 114.38 119.06 3i05 h ARG 191 Ca 0.16 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 60.08 3i05 h ARG 191 Cb 0.13 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 29.98 3i05 h ARG 191 CO -0.16 0.62 0.14 -1.49 -1.07 0.00 0.00 179.97 178.01 3i05 h TRP 192 N 0.84 0.93 0.00 3.04 4.06 -1.41 -2.95 115.95 120.47 3i05 h TRP 192 Ca 0.22 -0.09 0.00 0.00 2.06 0.00 0.00 58.89 61.08 3i05 h TRP 192 Cb -0.01 -0.27 0.00 0.00 -1.00 0.00 0.00 29.16 27.88 3i05 h TRP 192 CO -0.02 0.77 -0.32 0.00 -3.56 0.00 0.00 178.44 175.32 3i05 n MET 193 N -4.26 0.23 -0.17 0.49 0.00 -0.84 -4.32 117.12 108.24 3i05 n MET 193 Ca 0.04 0.12 -0.10 0.00 0.00 0.00 0.00 57.70 57.76 3i05 n MET 193 Cb 0.23 -1.70 0.00 0.00 0.00 0.00 0.00 33.22 31.76 3i05 n MET 193 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 175.97 176.32 3i05 h PHE 194 N 0.00 1.00 -0.98 3.17 3.57 -1.22 -3.21 116.94 119.27 3i05 h PHE 194 Ca 0.00 -0.18 0.34 0.00 3.53 0.00 0.00 57.97 61.65 3i05 h PHE 194 Cb 0.70 -0.26 -0.16 0.00 2.79 0.00 0.00 35.95 39.02 3i05 h PHE 194 CO 0.00 0.94 0.48 -1.35 -2.23 0.00 0.00 178.31 176.15 3i05 h PRO 195 N 0.77 0.18 -0.30 6.41 0.11 -1.76 0.56 132.00 137.97 3i05 h PRO 195 Ca 0.14 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 66.17 3i05 h PRO 195 Cb 0.56 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.61 3i05 h PRO 195 CO 0.03 0.12 -0.10 0.00 -0.21 0.00 0.00 178.00 177.84 3i05 h ALA 196 N 1.90 1.26 -0.41 -0.75 0.00 -1.88 -0.44 119.26 118.94 3i05 h ALA 196 Ca 0.74 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 55.31 3i05 h ALA 196 Cb 1.74 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.38 3i05 h ALA 196 CO -0.69 0.49 -0.06 0.82 0.00 0.00 0.00 179.25 179.81 3i05 h ILE 197 N 0.47 1.24 -0.05 0.00 2.04 -0.03 0.12 117.51 121.31 3i05 h ILE 197 Ca 0.09 -1.03 -0.16 0.00 1.00 0.00 0.00 64.86 64.76 3i05 h ILE 197 Cb 0.47 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 3i05 h ILE 197 CO 0.03 0.35 -0.68 -0.61 0.00 0.00 0.00 178.15 177.24 3i05 h GLN 198 N 0.64 0.22 -0.39 2.37 4.15 -0.94 -3.22 115.11 117.94 3i05 h GLN 198 Ca 0.12 -0.17 -0.09 0.00 0.77 0.00 0.00 58.65 59.27 3i05 h GLN 198 Cb 0.49 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.20 3i05 h GLN 198 CO 0.03 0.82 -0.12 0.00 -1.93 0.00 0.00 178.83 177.63 3i05 h ALA 199 N 1.13 0.54 -0.83 3.38 0.00 -0.58 -3.38 119.26 119.53 3i05 h ALA 199 Ca -0.02 -0.33 0.20 0.00 0.00 0.00 0.00 54.91 54.77 3i05 h ALA 199 Cb 1.22 -0.14 -0.14 0.00 0.00 0.00 0.00 17.79 18.74 3i05 h ALA 199 CO 0.10 0.42 0.14 0.00 0.00 0.00 0.00 179.25 179.92 3i05 h ALA 200 N 0.83 1.07 0.00 0.00 0.00 -0.99 0.91 119.26 121.07 3i05 h ALA 200 Ca 0.09 0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 3i05 h ALA 200 Cb 0.65 0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 3i05 h ALA 200 CO 0.04 -0.44 -0.03 -1.35 0.00 0.00 0.00 179.25 177.48 3i05 h PRO 201 N 0.18 0.00 0.00 0.00 0.11 -1.76 -1.78 132.00 128.75 3i05 h PRO 201 Ca 0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.60 3i05 h PRO 201 Cb 0.93 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.04 3i05 h PRO 201 CO -0.65 0.03 0.10 0.43 -0.21 0.00 0.00 178.00 177.70 3i05 n SER 202 N -3.46 0.00 -4.17 -2.05 7.64 0.31 -4.62 113.62 107.28 3i05 n SER 202 Ca -0.02 0.37 -0.29 0.00 1.01 0.00 0.00 58.87 59.94 3i05 n SER 202 Cb 0.14 -0.37 -0.17 0.00 -1.01 0.00 0.00 64.21 62.80 3i05 n SER 202 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3i05 s PHE 203 N -2.73 2.16 0.45 1.43 0.08 -0.67 -4.66 117.98 114.03 3i05 s PHE 203 Ca 0.00 -0.80 0.32 0.00 0.12 0.00 0.00 56.93 56.57 3i05 s PHE 203 Cb 0.00 -1.46 1.68 0.00 -0.57 0.00 0.00 43.02 42.67 3i05 s PHE 203 CO 0.00 -0.32 2.14 0.66 -0.10 0.00 0.00 175.22 177.60 3i05 h SER 204 N 6.62 0.00 -0.06 1.36 4.64 -1.82 -0.68 113.55 123.61 3i05 h SER 204 Ca -0.26 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.08 3i05 h SER 204 Cb 1.21 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3i05 h SER 204 CO 0.47 0.07 0.11 0.00 -0.87 0.00 0.00 176.83 176.61 3i05 h ALA 205 N 1.93 1.45 0.00 5.18 0.00 -1.91 -2.12 119.26 123.79 3i05 h ALA 205 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3i05 h ALA 205 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3i05 h ALA 205 CO 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 179.25 179.11 3i05 n ALA 206 N -2.20 1.56 -3.27 0.00 0.00 -0.26 -4.09 120.51 112.26 3i05 n ALA 206 Ca -0.01 0.07 -0.25 0.00 0.00 0.00 0.00 53.44 53.25 3i05 n ALA 206 Cb 0.20 -1.34 -0.07 0.00 0.00 0.00 0.00 19.45 18.24 3i05 n ALA 206 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3i05 n PHE 207 N -2.08 0.81 0.25 0.00 3.72 -0.80 -4.55 117.46 114.81 3i05 n PHE 207 Ca 0.02 -3.73 0.11 0.00 -0.05 0.00 0.00 57.45 53.79 3i05 n PHE 207 Cb 0.19 -0.40 0.66 0.00 -0.94 0.00 0.00 39.48 38.98 3i05 n PHE 207 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3i05 h PRO 208 N 4.09 0.00 0.00 -1.08 0.13 -1.71 0.27 132.00 133.71 3i05 h PRO 208 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3i05 h PRO 208 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 3i05 h PRO 208 CO 0.57 0.15 0.00 -2.39 -0.23 0.00 0.00 178.00 176.10 3i05 n HIS 209 N -3.77 0.06 0.00 1.56 1.44 -1.26 -3.52 115.22 109.73 3i05 n HIS 209 Ca -0.02 0.03 0.00 0.00 -2.01 0.00 0.00 57.72 55.72 3i05 n HIS 209 Cb 0.26 -0.54 0.00 0.00 0.12 0.00 0.00 29.99 29.82 3i05 n HIS 209 CO 0.00 0.00 0.00 1.51 -2.81 0.00 0.00 176.34 175.04 3i05 n ILE 210 N -1.56 0.00 -3.98 0.61 3.06 -0.46 -2.42 119.36 114.62 3i05 n ILE 210 Ca 0.03 0.00 -0.31 0.00 -2.50 0.00 0.00 62.75 59.97 3i05 n ILE 210 Cb 0.15 -0.89 -0.15 0.00 0.54 0.00 0.00 39.64 39.29 3i05 n ILE 210 CO 0.00 0.00 0.00 -0.36 -2.50 0.00 0.00 176.55 173.69 3i05 s PHE 211 N -1.99 3.20 0.32 9.51 0.40 0.83 -2.91 117.98 127.34 3i05 s PHE 211 Ca 0.00 -2.54 -0.29 0.00 -0.60 0.00 0.00 56.93 53.50 3i05 s PHE 211 Cb 0.00 -2.40 -0.10 0.00 0.51 0.00 0.00 43.02 41.02 3i05 s PHE 211 CO 0.00 -0.90 1.28 -1.25 0.70 0.00 0.00 175.22 175.05 3i05 s PRO 212 N 1.10 4.40 0.32 0.24 0.04 -1.24 -4.01 135.00 135.86 3i05 s PRO 212 Ca 0.05 2.15 0.24 0.00 0.04 0.00 0.00 61.00 63.48 3i05 s PRO 212 Cb -0.19 -3.09 1.17 0.00 0.04 0.00 0.00 34.50 32.43 3i05 s PRO 212 CO -0.10 -0.14 1.72 -1.00 0.04 0.00 0.00 177.00 177.52 3i05 h PRO 213 N 3.57 0.00 0.00 0.56 0.13 -1.90 -1.63 132.00 132.73 3i05 h PRO 213 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3i05 h PRO 213 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 3i05 h PRO 213 CO 0.66 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.30 3i05 n SER 214 N -2.31 0.00 -0.20 1.44 3.41 -1.26 -3.19 113.62 111.51 3i05 n SER 214 Ca -0.00 0.15 0.08 0.00 -0.26 0.00 0.00 58.87 58.84 3i05 n SER 214 Cb 0.11 -0.37 -0.05 0.00 -0.26 0.00 0.00 64.21 63.64 3i05 n SER 214 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3i05 n MET 215 N -1.37 1.62 0.00 4.33 2.81 -0.61 -5.10 117.12 118.80 3i05 n MET 215 Ca 0.09 -0.43 0.00 0.00 -1.81 0.00 0.00 57.70 55.55 3i05 n MET 215 Cb 0.22 -1.29 0.00 0.00 -0.71 0.00 0.00 33.22 31.44 3i05 n MET 215 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3i05 n GLY 216 N 1.29 -1.31 3.75 3.03 0.00 -1.19 -4.91 105.19 105.84 3i05 n GLY 216 Ca 0.05 -1.27 -0.40 0.00 0.00 0.00 0.00 46.02 44.40 3i05 n GLY 216 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3i05 s ASN 217 N -4.00 7.50 -0.10 1.61 0.01 -1.26 -4.88 114.94 113.82 3i05 s ASN 217 Ca 0.00 1.78 0.02 0.00 -0.71 0.00 0.00 52.86 53.96 3i05 s ASN 217 Cb 0.00 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 39.08 3i05 s ASN 217 CO 0.00 0.09 -0.17 -0.69 -1.51 0.00 0.00 177.10 174.82 3i05 s VAL 218 N -0.73 2.74 0.39 1.60 1.01 -1.26 -5.08 120.40 119.07 3i05 s VAL 218 Ca 0.41 -0.80 -0.27 0.00 0.00 0.00 0.00 61.98 61.32 3i05 s VAL 218 Cb -0.24 -2.10 -0.10 0.00 0.00 0.00 0.00 36.38 33.94 3i05 s VAL 218 CO 0.29 0.55 1.46 0.12 0.00 0.00 0.00 175.10 177.52 3i05 s PHE 219 N 0.04 2.59 -0.05 5.22 2.19 -1.26 -4.40 117.98 122.31 3i05 s PHE 219 Ca -0.06 1.21 0.05 0.00 0.33 0.00 0.00 56.93 58.45 3i05 s PHE 219 Cb -0.15 -3.98 -0.02 0.00 -1.31 0.00 0.00 43.02 37.57 3i05 s PHE 219 CO 0.05 -2.90 -0.19 0.00 1.83 0.00 0.00 175.22 174.01 3i05 s LEU 221 N -0.50 2.18 -0.24 0.00 2.96 0.15 -0.10 118.68 123.13 3i05 s LEU 221 Ca 0.06 -0.55 0.00 0.00 -0.22 0.00 0.00 54.13 53.42 3i05 s LEU 221 Cb -0.11 -1.45 0.04 0.00 0.50 0.00 0.00 46.19 45.16 3i05 s LEU 221 CO 0.01 0.13 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.44 3i05 s ILE 222 N 0.55 2.55 -0.09 6.68 1.01 -0.17 -2.17 121.20 129.56 3i05 s ILE 222 Ca -0.13 -1.21 -0.28 0.00 0.00 0.00 0.00 60.65 59.03 3i05 s ILE 222 Cb -0.17 -2.33 -0.02 0.00 0.01 0.00 0.00 42.46 39.96 3i05 s ILE 222 CO 0.04 0.17 0.93 -2.16 0.00 0.00 0.00 174.94 173.92 3i05 s PRO 223 N 1.25 4.44 -0.07 2.79 0.05 -1.26 -1.81 135.00 140.38 3i05 s PRO 223 Ca -0.02 1.27 -0.20 0.00 0.05 0.00 0.00 61.00 62.09 3i05 s PRO 223 Cb -0.17 -3.52 0.04 0.00 0.05 0.00 0.00 34.50 30.91 3i05 s PRO 223 CO -0.06 -0.20 0.47 1.14 0.05 0.00 0.00 177.00 178.40 3i05 s GLN 224 N 1.63 0.76 0.45 4.56 -2.07 -0.87 -4.91 119.66 119.21 3i05 s GLN 224 Ca 0.46 0.19 -0.24 0.00 -1.82 0.00 0.00 55.36 53.95 3i05 s GLN 224 Cb -0.19 0.35 -0.07 0.00 -1.09 0.00 0.00 33.01 32.01 3i05 s GLN 224 CO 0.19 -0.19 1.29 0.00 -1.32 0.00 0.00 175.29 175.26 3i05 s ALA 225 N -0.83 3.08 0.44 2.60 0.00 -1.26 -2.11 121.76 123.68 3i05 s ALA 225 Ca -0.09 1.19 0.18 0.00 0.00 0.00 0.00 51.96 53.24 3i05 s ALA 225 Cb -0.03 -3.48 1.12 0.00 0.00 0.00 0.00 23.12 20.72 3i05 s ALA 225 CO 0.05 -0.93 1.91 0.97 0.00 0.00 0.00 175.76 177.76 3i05 h ILE 226 N 2.07 0.75 -0.79 0.00 6.09 -1.80 -2.35 117.51 121.47 3i05 h ILE 226 Ca -0.50 -0.12 0.18 0.00 -1.37 0.00 0.00 64.86 63.05 3i05 h ILE 226 Cb 1.26 0.36 -0.05 0.00 0.47 0.00 0.00 36.82 38.86 3i05 h ILE 226 CO 0.61 0.06 0.53 -2.24 -3.07 0.00 0.00 178.15 174.04 3i05 h ASP 227 N 0.35 0.28 0.96 2.19 3.04 -1.90 -2.71 116.42 118.63 3i05 h ASP 227 Ca 0.39 0.02 0.00 0.00 -3.24 0.00 0.00 57.03 54.20 3i05 h ASP 227 Cb 1.00 -0.03 0.00 0.00 -1.04 0.00 0.00 39.33 39.25 3i05 h ASP 227 CO -0.12 0.13 -0.15 0.00 -2.04 0.00 0.00 179.24 177.07 3i05 n GLN 228 N -4.44 0.06 -0.26 4.15 1.13 -0.89 -4.17 117.38 112.96 3i05 n GLN 228 Ca 0.16 0.04 0.05 0.00 -1.94 0.00 0.00 57.00 55.31 3i05 n GLN 228 Cb 0.66 -1.56 0.19 0.00 0.11 0.00 0.00 30.24 29.63 3i05 n GLN 228 CO 0.00 0.00 0.00 0.22 -1.44 0.00 0.00 177.06 175.84 3i05 h ASP 229 N 0.00 0.28 0.00 1.08 3.58 -1.66 -2.52 116.42 117.18 3i05 h ASP 229 Ca 0.00 0.11 0.00 0.00 0.42 0.00 0.00 57.03 57.56 3i05 h ASP 229 Cb 0.55 0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.69 3i05 h ASP 229 CO 0.00 0.10 0.08 1.55 -2.88 0.00 0.00 179.24 178.10 3i05 h PRO 230 N 0.44 0.00 0.00 0.28 0.13 -1.82 -0.96 132.00 130.08 3i05 h PRO 230 Ca 0.41 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.44 3i05 h PRO 230 Cb 0.62 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.74 3i05 h PRO 230 CO -0.40 0.00 -0.50 1.88 -0.23 0.00 0.00 178.00 178.75 3i05 h TYR 231 N 0.00 0.00 0.00 1.56 -1.99 -1.76 -3.40 116.97 111.39 3i05 h TYR 231 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3i05 h TYR 231 Cb 0.17 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.90 3i05 h TYR 231 CO 0.00 0.50 -1.13 0.34 -0.00 0.00 0.00 178.16 177.87 3i05 n PHE 232 N -3.66 0.00 -0.24 4.88 7.35 -0.38 -3.67 117.46 121.73 3i05 n PHE 232 Ca -0.01 0.00 0.24 0.00 -0.76 0.00 0.00 57.45 56.92 3i05 n PHE 232 Cb 0.57 -0.14 0.59 0.00 0.35 0.00 0.00 39.48 40.85 3i05 n PHE 232 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3i05 h ARG 233 N 0.00 0.24 0.35 -4.13 3.08 -1.72 -0.80 114.38 111.41 3i05 h ARG 233 Ca 0.00 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 3i05 h ARG 233 Cb 0.33 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.30 3i05 h ARG 233 CO 0.00 0.16 -0.45 1.25 -1.07 0.00 0.00 179.97 179.86 3i05 h LEU 234 N 0.25 -1.27 -1.54 3.04 5.85 -1.85 -2.07 115.31 117.72 3i05 h LEU 234 Ca 0.49 0.11 -0.04 0.00 0.84 0.00 0.00 57.88 59.27 3i05 h LEU 234 Cb 1.47 0.43 -0.01 0.00 0.37 0.00 0.00 40.66 42.93 3i05 h LEU 234 CO -0.14 -0.56 -0.20 0.00 -0.34 0.00 0.00 178.44 177.20 3i05 h THR 235 N -0.83 0.70 -0.03 1.05 1.03 -1.52 -3.11 112.91 110.20 3i05 h THR 235 Ca -0.04 -0.87 -0.22 0.00 -0.01 0.00 0.00 66.41 65.27 3i05 h THR 235 Cb 0.74 1.54 0.02 0.00 -1.07 0.00 0.00 68.15 69.38 3i05 h THR 235 CO -0.11 0.20 -0.85 0.03 -0.01 0.00 0.00 175.52 174.78 3i05 h ARG 236 N 0.00 0.62 0.00 0.00 3.08 -1.09 -3.32 114.38 113.68 3i05 h ARG 236 Ca -0.00 -0.63 0.00 0.00 0.07 0.00 0.00 59.98 59.41 3i05 h ARG 236 Cb 0.53 0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.75 3i05 h ARG 236 CO 0.03 1.24 0.00 0.38 -1.07 0.00 0.00 179.97 180.55 3i05 h ASP 237 N 0.26 0.00 0.14 7.04 -0.00 -1.31 -3.10 116.42 119.45 3i05 h ASP 237 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.93 3i05 h ASP 237 Cb 1.51 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.84 3i05 h ASP 237 CO 0.17 0.00 -0.21 0.00 -0.00 0.00 0.00 179.24 179.20 3i05 n ILE 238 N -2.52 0.00 0.28 4.15 0.13 -1.22 -4.46 119.36 115.72 3i05 n ILE 238 Ca 0.04 -0.19 -0.16 0.00 -1.10 0.00 0.00 62.75 61.34 3i05 n ILE 238 Cb 0.40 0.56 -0.08 0.00 -0.84 0.00 0.00 39.64 39.68 3i05 n ILE 238 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3i05 h ALA 239 N 3.91 -0.66 0.00 1.51 0.00 -1.66 -2.99 119.26 119.36 3i05 h ALA 239 Ca 0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 3i05 h ALA 239 Cb 0.55 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 3i05 h ALA 239 CO 0.00 -0.88 -0.09 -1.35 0.00 0.00 0.00 179.25 176.93 3i05 h PRO 240 N -0.66 0.00 0.00 0.00 0.11 -1.78 0.19 132.00 129.86 3i05 h PRO 240 Ca -0.06 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.00 3i05 h PRO 240 Cb 0.52 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.62 3i05 h PRO 240 CO 0.10 0.09 -0.20 0.00 -0.21 0.00 0.00 178.00 177.77 3i05 h ARG 241 N 0.00 0.00 -0.00 1.05 -0.00 -1.81 -0.61 114.38 113.01 3i05 h ARG 241 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 3i05 h ARG 241 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.18 3i05 h ARG 241 CO 0.01 0.20 -0.31 1.28 0.00 0.00 0.00 179.97 181.16 3i05 n LEU 242 N -4.00 0.78 -0.56 3.04 4.32 -0.26 -4.93 117.00 115.39 3i05 n LEU 242 Ca -0.02 -0.14 -0.06 0.00 -0.02 0.00 0.00 56.01 55.77 3i05 n LEU 242 Cb 0.28 -0.18 -0.02 0.00 -1.62 0.00 0.00 43.42 41.89 3i05 n LEU 242 CO 0.35 0.16 -0.07 0.61 -1.22 0.00 0.00 177.39 177.21 3i05 n GLY 243 N 1.39 0.59 4.01 -0.72 0.00 -0.24 -5.03 105.19 105.19 3i05 n GLY 243 Ca 0.10 -0.72 -0.19 0.00 0.00 0.00 0.00 46.02 45.21 3i05 n GLY 243 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3i05 s TYR 244 N -2.26 2.02 -0.39 1.61 2.02 0.50 -4.94 117.35 115.91 3i05 s TYR 244 Ca 0.00 -0.60 -0.11 0.00 -0.37 0.00 0.00 57.07 56.00 3i05 s TYR 244 Cb 0.00 -2.25 0.04 0.00 -0.40 0.00 0.00 41.96 39.35 3i05 s TYR 244 CO 0.00 -0.78 0.23 -1.17 -1.57 0.00 0.00 175.55 172.26 3i05 s LEU 245 N -4.49 4.88 -0.38 -1.29 2.96 -1.26 -3.52 118.68 115.57 3i05 s LEU 245 Ca 0.57 -1.16 -0.42 0.00 -0.22 0.00 0.00 54.13 52.90 3i05 s LEU 245 Cb -0.07 -2.02 -0.16 0.00 0.50 0.00 0.00 46.19 44.44 3i05 s LEU 245 CO 0.35 -0.44 1.87 2.29 -1.32 0.00 0.00 176.35 179.09 3i05 n LYS 246 N 4.98 0.67 -2.39 1.98 2.85 -1.26 -4.84 118.16 120.15 3i05 n LYS 246 Ca -0.11 0.23 -0.39 0.00 -1.05 0.00 0.00 58.31 56.99 3i05 n LYS 246 Cb 0.45 -1.92 -0.03 0.00 -0.65 0.00 0.00 35.03 32.88 3i05 n LYS 246 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 3i05 s PRO 247 N 4.36 4.26 0.51 -1.58 0.04 -1.26 -4.92 135.00 136.42 3i05 s PRO 247 Ca 1.06 1.77 -0.18 0.00 0.04 0.00 0.00 61.00 63.69 3i05 s PRO 247 Cb -1.21 -2.81 -0.07 0.00 0.04 0.00 0.00 34.50 30.44 3i05 s PRO 247 CO 0.67 -0.12 1.02 0.00 0.04 0.00 0.00 177.00 178.61 3i05 s ALA 248 N -1.38 2.89 0.02 8.56 0.00 0.86 -4.94 121.76 127.77 3i05 s ALA 248 Ca 0.53 0.44 0.03 0.00 0.00 0.00 0.00 51.96 52.97 3i05 s ALA 248 Cb -0.30 -3.21 -0.02 0.00 0.00 0.00 0.00 23.12 19.60 3i05 s ALA 248 CO 0.37 -0.37 -0.10 0.08 0.00 0.00 0.00 175.76 175.74 3i05 s VAL 249 N -2.25 0.81 -0.09 0.00 1.01 -0.83 -1.00 120.40 118.04 3i05 s VAL 249 Ca 0.64 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.93 3i05 s VAL 249 Cb -0.14 -0.73 0.01 0.00 0.00 0.00 0.00 36.38 35.52 3i05 s VAL 249 CO 0.26 0.02 -0.16 -0.51 0.00 0.00 0.00 175.10 174.70 3i05 s ILE 250 N -0.64 1.51 -0.17 2.22 2.07 -0.75 -0.68 121.20 124.76 3i05 s ILE 250 Ca 0.00 -0.68 -0.08 0.00 -1.41 0.00 0.00 60.65 58.48 3i05 s ILE 250 Cb -0.06 -1.35 -0.05 0.00 0.13 0.00 0.00 42.46 41.13 3i05 s ILE 250 CO 0.00 0.44 0.12 -1.00 -1.91 0.00 0.00 174.94 172.59 3i05 s HIS 251 N 0.68 3.45 0.17 3.50 3.76 0.14 -2.06 115.29 124.93 3i05 s HIS 251 Ca -0.13 0.37 0.03 0.00 -0.15 0.00 0.00 55.06 55.18 3i05 s HIS 251 Cb -0.16 -2.06 -0.03 0.00 1.11 0.00 0.00 32.58 31.43 3i05 s HIS 251 CO 0.03 0.43 0.26 -1.54 -0.85 0.00 0.00 174.74 173.08 3i05 s SER 252 N -0.15 6.14 0.70 1.40 1.04 -0.90 -0.89 113.70 121.04 3i05 s SER 252 Ca 0.10 0.08 -0.11 0.00 0.48 0.00 0.00 55.95 56.50 3i05 s SER 252 Cb -0.11 -1.79 0.01 0.00 0.10 0.00 0.00 66.02 64.22 3i05 s SER 252 CO 0.00 0.04 1.08 -0.54 0.98 0.00 0.00 173.24 174.80 3i05 s LYS 253 N -3.33 2.92 0.41 4.02 1.02 0.73 -2.30 119.74 123.21 3i05 s LYS 253 Ca 0.34 0.60 -0.26 0.00 0.02 0.00 0.00 55.97 56.67 3i05 s LYS 253 Cb -0.10 -2.02 -0.09 0.00 -0.52 0.00 0.00 37.83 35.10 3i05 s LYS 253 CO 0.27 -1.02 1.35 -0.06 -0.92 0.00 0.00 175.35 174.97 3i05 s PHE 254 N -3.26 2.73 -0.09 3.18 0.08 -1.26 -4.89 117.98 114.47 3i05 s PHE 254 Ca 0.58 1.36 -0.24 0.00 0.12 0.00 0.00 56.93 58.74 3i05 s PHE 254 Cb -0.12 -3.76 -0.03 0.00 -0.57 0.00 0.00 43.02 38.54 3i05 s PHE 254 CO 0.53 -2.35 0.75 0.12 -0.10 0.00 0.00 175.22 174.17 3i05 s PHE 255 N -1.23 3.54 -0.04 0.36 5.36 -1.26 -5.05 117.98 119.66 3i05 s PHE 255 Ca 0.57 1.27 -0.27 0.00 -0.96 0.00 0.00 56.93 57.54 3i05 s PHE 255 Cb -0.40 -2.87 -0.03 0.00 -0.34 0.00 0.00 43.02 39.38 3i05 s PHE 255 CO 0.52 0.00 0.85 -1.25 -1.46 0.00 0.00 175.22 173.88 3i05 s PRO 256 N 1.13 4.49 0.00 10.12 0.04 -1.26 -5.06 135.00 144.46 3i05 s PRO 256 Ca 0.38 1.16 0.00 0.00 0.04 0.00 0.00 61.00 62.58 3i05 s PRO 256 Cb -0.18 -3.46 0.00 0.00 0.04 0.00 0.00 34.50 30.90 3i05 s PRO 256 CO 0.17 -0.02 0.00 0.41 0.04 0.00 0.00 177.00 177.60 3i05 n GLY 257 N 3.02 -0.48 0.00 0.56 0.00 -1.26 -4.99 105.19 102.04 3i05 n GLY 257 Ca 0.03 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.89 3i05 n GLY 257 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3i05 n LEU 258 N 0.00 0.09 0.00 0.99 7.99 -1.26 -5.04 117.00 119.77 3i05 n LEU 258 Ca 0.00 -0.09 0.00 0.00 -0.01 0.00 0.00 56.01 55.91 3i05 n LEU 258 Cb 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.31 3i05 n LEU 258 CO 0.00 0.02 0.00 -1.20 -1.51 0.00 0.00 177.39 174.70 3i05 n SER 259 N -0.01 0.00 -3.88 -1.43 7.64 -1.26 -5.15 113.62 109.52 3i05 n SER 259 Ca 0.00 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.79 3i05 n SER 259 Cb 0.30 0.01 -0.06 0.00 -1.01 0.00 0.00 64.21 63.45 3i05 n SER 259 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3i05 s ALA 272 N -1.98 -0.27 -0.18 -0.43 0.00 -1.26 -5.27 121.76 112.37 3i05 s ALA 272 Ca 0.00 -0.67 -0.11 0.00 0.00 0.00 0.00 51.96 51.18 3i05 s ALA 272 Cb 0.00 0.81 -0.05 0.00 0.00 0.00 0.00 23.12 23.88 3i05 s ALA 272 CO 0.00 -0.67 0.20 0.08 0.00 0.00 0.00 175.76 175.37 3i05 s VAL 273 N -3.93 5.37 0.14 0.00 1.01 -1.26 -5.05 120.40 116.68 3i05 s VAL 273 Ca 0.13 0.33 0.08 0.00 0.00 0.00 0.00 61.98 62.53 3i05 s VAL 273 Cb 0.02 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.83 3i05 s VAL 273 CO -0.02 0.43 -0.10 -0.76 0.00 0.00 0.00 175.10 174.65 3i05 s LEU 274 N 0.31 2.99 0.64 3.92 1.43 -1.26 -1.20 118.68 125.51 3i05 s LEU 274 Ca 0.12 -0.48 0.39 0.00 -1.03 0.00 0.00 54.13 53.13 3i05 s LEU 274 Cb -0.12 -1.74 2.22 0.00 0.03 0.00 0.00 46.19 46.58 3i05 s LEU 274 CO 0.01 0.15 2.33 -0.07 0.23 0.00 0.00 176.35 179.00 3i05 h LEU 275 N 3.32 0.00 -0.32 1.79 3.38 -1.72 -1.56 115.31 120.20 3i05 h LEU 275 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 3i05 h LEU 275 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 3i05 h LEU 275 CO 0.52 0.00 -0.20 0.35 0.09 0.00 0.00 178.44 179.20 3i05 n THR 276 N -3.36 0.00 -2.12 0.22 -2.24 -1.26 -4.60 114.28 100.91 3i05 n THR 276 Ca -0.03 -0.08 -0.39 0.00 -2.27 0.00 0.00 64.05 61.27 3i05 n THR 276 Cb 0.07 0.14 -0.01 0.00 -2.10 0.00 0.00 70.33 68.43 3i05 n THR 276 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3i05 s ASP 277 N -2.55 6.42 0.81 3.42 1.01 -0.59 -5.03 116.67 120.16 3i05 s ASP 277 Ca 0.25 2.57 -0.12 0.00 0.71 0.00 0.00 52.55 55.96 3i05 s ASP 277 Cb 0.19 -2.63 0.08 0.00 1.01 0.00 0.00 42.92 41.57 3i05 s ASP 277 CO 0.52 -0.77 1.14 0.42 0.21 0.00 0.00 175.17 176.69 3i05 s THR 278 N -1.28 2.48 0.22 -1.27 -4.23 -1.26 -4.83 115.64 105.46 3i05 s THR 278 Ca 0.56 0.15 -0.08 0.00 -1.18 0.00 0.00 61.69 61.14 3i05 s THR 278 Cb -0.36 -3.06 0.16 0.00 1.34 0.00 0.00 72.50 70.58 3i05 s THR 278 CO 0.47 -0.20 1.74 -0.33 -0.54 0.00 0.00 174.62 175.75 3i05 h GLU 279 N -1.07 0.39 -0.45 3.99 5.08 -1.96 -1.49 114.58 119.07 3i05 h GLU 279 Ca -0.47 -0.02 0.05 0.00 -1.00 0.00 0.00 59.36 57.92 3i05 h GLU 279 Cb 1.31 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 30.42 3i05 h GLU 279 CO 0.64 0.26 0.18 1.57 -1.00 0.00 0.00 179.01 180.65 3i05 h LYS 280 N 0.40 0.35 -0.33 2.33 2.10 -1.99 -0.24 116.57 119.20 3i05 h LYS 280 Ca 0.33 -0.02 -0.12 0.00 -2.00 0.00 0.00 60.65 58.84 3i05 h LYS 280 Cb 0.44 -0.08 -0.01 0.00 -0.90 0.00 0.00 32.23 31.69 3i05 h LYS 280 CO -0.34 0.23 -0.28 0.52 -2.00 0.00 0.00 179.45 177.58 3i05 h MET 281 N 0.36 0.77 -0.69 0.07 2.86 -1.76 0.21 114.93 116.75 3i05 h MET 281 Ca 0.21 -0.39 0.01 0.00 -2.06 0.00 0.00 59.70 57.47 3i05 h MET 281 Cb 0.19 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.82 3i05 h MET 281 CO -0.20 1.02 0.45 0.28 1.06 0.00 0.00 176.91 179.52 3i05 h VAL 282 N 0.55 1.17 -0.34 -2.22 2.07 -1.08 0.37 116.25 116.76 3i05 h VAL 282 Ca 0.06 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 67.24 3i05 h VAL 282 Cb 0.85 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 3i05 h VAL 282 CO 0.07 0.17 0.14 0.11 0.02 0.00 0.00 177.57 178.08 3i05 h LYS 283 N 0.92 0.51 0.11 1.57 6.56 -0.64 -2.75 116.57 122.85 3i05 h LYS 283 Ca 0.26 -0.09 -0.01 0.00 -1.06 0.00 0.00 60.65 59.75 3i05 h LYS 283 Cb -0.09 -0.08 0.00 0.00 -0.57 0.00 0.00 32.23 31.49 3i05 h LYS 283 CO -0.06 0.50 -0.05 -0.44 -2.06 0.00 0.00 179.45 177.34 3i05 h ASP 284 N 0.41 -0.12 -0.88 0.86 5.19 -0.24 -2.92 116.42 118.72 3i05 h ASP 284 Ca 0.11 -0.29 0.11 0.00 -0.62 0.00 0.00 57.03 56.34 3i05 h ASP 284 Cb 0.18 0.03 -0.06 0.00 0.18 0.00 0.00 39.33 39.66 3i05 h ASP 284 CO -0.01 0.23 0.57 0.11 -3.12 0.00 0.00 179.24 177.02 3i05 h LYS 285 N -0.49 0.80 0.24 3.56 1.57 -0.29 -2.96 116.57 118.99 3i05 h LYS 285 Ca -0.01 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 3i05 h LYS 285 Cb 0.40 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.54 3i05 h LYS 285 CO 0.02 0.53 -0.11 0.82 -0.57 0.00 0.00 179.45 180.14 3i05 h ILE 286 N 0.82 0.68 -2.24 1.86 2.04 -1.49 -3.43 117.51 115.75 3i05 h ILE 286 Ca 0.41 -0.92 -0.58 0.00 1.00 0.00 0.00 64.86 64.78 3i05 h ILE 286 Cb 0.48 1.10 0.03 0.00 -0.74 0.00 0.00 36.82 37.69 3i05 h ILE 286 CO -0.18 0.16 1.06 0.59 0.00 0.00 0.00 178.15 179.78 3i05 n ASN 287 N -5.01 3.62 0.00 1.72 5.03 -1.10 -5.13 115.26 114.39 3i05 n ASN 287 Ca -0.08 0.99 0.00 0.00 0.87 0.00 0.00 54.58 56.36 3i05 n ASN 287 Cb 0.26 -1.45 0.00 0.00 -1.02 0.00 0.00 39.78 37.57 3i05 n ASN 287 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3i05 n LYS 288 N 5.83 0.00 0.00 3.52 5.02 -1.26 -4.91 118.16 126.37 3i05 n LYS 288 Ca 0.20 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 3i05 n LYS 288 Cb 0.33 -0.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.84 3i05 n LYS 288 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 3i05 n PRO 313 N -1.10 0.00 -0.30 1.97 -0.04 -1.26 -5.03 135.00 129.24 3i05 n PRO 313 Ca 0.00 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.53 3i05 n PRO 313 Cb 0.06 0.00 0.22 0.00 -0.04 0.00 0.00 33.50 33.75 3i05 n PRO 313 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 3i05 h ILE 314 N 0.00 0.76 -0.37 0.52 5.03 -1.99 -0.88 117.51 120.57 3i05 h ILE 314 Ca 0.00 -0.23 -0.00 0.00 -0.12 0.00 0.00 64.86 64.51 3i05 h ILE 314 Cb 0.00 0.03 -0.02 0.00 -3.03 0.00 0.00 36.82 33.80 3i05 h ILE 314 CO 0.00 0.12 0.23 1.56 -0.68 0.00 0.00 178.15 179.38 3i05 h GLN 315 N 0.67 0.50 -0.72 2.37 4.20 -2.01 -1.75 115.11 118.37 3i05 h GLN 315 Ca 0.46 -0.04 0.12 0.00 0.06 0.00 0.00 58.65 59.25 3i05 h GLN 315 Cb 0.62 -0.11 -0.08 0.00 0.30 0.00 0.00 27.48 28.22 3i05 h GLN 315 CO -0.34 0.37 0.32 -1.49 -0.67 0.00 0.00 178.83 177.02 3i05 h TRP 316 N 0.49 0.56 -0.47 2.96 4.06 -1.60 -0.48 115.95 121.47 3i05 h TRP 316 Ca 0.13 0.03 -0.05 0.00 2.06 0.00 0.00 58.89 61.07 3i05 h TRP 316 Cb -0.00 -0.14 -0.02 0.00 -1.00 0.00 0.00 29.16 27.99 3i05 h TRP 316 CO -0.04 0.14 0.11 -0.07 -3.56 0.00 0.00 178.44 175.02 3i05 h LEU 317 N 0.51 0.66 -1.52 -4.49 3.38 -0.89 -1.69 115.31 111.28 3i05 h LEU 317 Ca 0.38 -0.11 0.11 0.00 0.09 0.00 0.00 57.88 58.34 3i05 h LEU 317 Cb 0.49 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.02 3i05 h LEU 317 CO -0.33 0.67 0.46 0.28 0.09 0.00 0.00 178.44 179.61 3i05 h SER 318 N 0.69 0.48 0.41 -0.43 0.02 -0.20 -0.99 113.55 113.54 3i05 h SER 318 Ca 0.16 0.01 -0.29 0.00 -0.84 0.00 0.00 61.79 60.83 3i05 h SER 318 Cb 0.27 -0.09 0.02 0.00 0.14 0.00 0.00 62.40 62.74 3i05 h SER 318 CO -0.00 0.28 -1.28 -0.26 -1.14 0.00 0.00 176.83 174.43 3i05 h PHE 319 N 0.53 0.74 0.00 3.45 -1.00 -0.87 -3.43 116.94 116.35 3i05 h PHE 319 Ca 0.33 -0.51 -0.10 0.00 2.81 0.00 0.00 57.97 60.50 3i05 h PHE 319 Cb 0.56 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 40.06 3i05 h PHE 319 CO -0.00 1.38 -1.37 1.19 -1.61 0.00 0.00 178.31 177.90 3i05 n PHE 320 N -3.65 0.00 -2.43 -0.55 3.72 -0.84 -4.96 117.46 108.74 3i05 n PHE 320 Ca -0.12 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.87 3i05 n PHE 320 Cb 1.02 -0.27 -0.03 0.00 -0.94 0.00 0.00 39.48 39.26 3i05 n PHE 320 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 3i05 s LEU 321 N -4.52 4.38 -0.13 4.37 2.96 -0.42 -4.97 118.68 120.35 3i05 s LEU 321 Ca -0.03 2.01 -0.22 0.00 -0.22 0.00 0.00 54.13 55.66 3i05 s LEU 321 Cb 0.02 -3.58 -0.26 0.00 0.50 0.00 0.00 46.19 42.87 3i05 s LEU 321 CO 0.21 -0.45 0.60 -0.33 -1.32 0.00 0.00 176.35 175.06 3i05 h GLU 322 N 6.70 0.12 -6.63 1.98 5.08 -1.93 -3.47 114.58 116.44 3i05 h GLU 322 Ca -0.42 -0.20 -0.51 0.00 -1.00 0.00 0.00 59.36 57.23 3i05 h GLU 322 Cb 1.21 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.52 3i05 h GLU 322 CO 0.80 1.10 0.32 0.16 -1.00 0.00 0.00 179.01 180.39 3i05 s ASP 323 N -6.72 7.54 0.01 1.42 1.47 -1.26 -4.97 116.67 114.15 3i05 s ASP 323 Ca -0.21 1.83 -0.18 0.00 1.18 0.00 0.00 52.55 55.17 3i05 s ASP 323 Cb 0.02 -2.58 -0.33 0.00 -0.34 0.00 0.00 42.92 39.68 3i05 s ASP 323 CO 0.71 0.08 0.98 0.44 0.68 0.00 0.00 175.17 178.06 3i05 h ASP 324 N 4.74 0.72 -0.20 2.11 3.45 -2.01 -3.28 116.42 121.95 3i05 h ASP 324 Ca -0.44 -0.92 -0.06 0.00 0.43 0.00 0.00 57.03 56.04 3i05 h ASP 324 Cb 1.20 -0.23 -0.02 0.00 -0.56 0.00 0.00 39.33 39.73 3i05 h ASP 324 CO 0.69 1.58 -0.04 1.05 -1.57 0.00 0.00 179.24 180.96 3i05 h GLU 325 N -0.02 0.51 0.00 3.56 4.11 -1.99 -1.35 114.58 119.39 3i05 h GLU 325 Ca -0.21 -0.12 -0.03 0.00 0.07 0.00 0.00 59.36 59.08 3i05 h GLU 325 Cb 1.94 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 31.12 3i05 h GLU 325 CO 0.23 0.56 -0.13 0.93 0.07 0.00 0.00 179.01 180.68 3i05 h GLU 326 N 0.48 0.00 -0.02 1.06 4.39 -1.99 0.20 114.58 118.70 3i05 h GLU 326 Ca 0.10 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.62 3i05 h GLU 326 Cb 0.37 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.04 3i05 h GLU 326 CO 0.02 0.13 -0.71 1.25 -1.16 0.00 0.00 179.01 178.53 3i05 h LEU 327 N 0.00 0.66 -0.48 1.33 5.85 -1.38 -2.58 115.31 118.70 3i05 h LEU 327 Ca -0.00 -0.74 -0.01 0.00 0.84 0.00 0.00 57.88 57.98 3i05 h LEU 327 Cb 0.64 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 3i05 h LEU 327 CO 0.02 1.30 0.27 0.00 -0.34 0.00 0.00 178.44 179.69 3i05 h ALA 328 N 0.37 0.61 -0.34 1.25 0.00 -0.78 0.37 119.26 120.73 3i05 h ALA 328 Ca -0.08 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.77 3i05 h ALA 328 Cb 1.39 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 3i05 h ALA 328 CO 0.14 0.12 0.17 0.07 0.00 0.00 0.00 179.25 179.75 3i05 h ARG 329 N 0.63 0.34 0.12 0.00 -0.00 -0.69 -2.44 114.38 112.34 3i05 h ARG 329 Ca 0.17 -0.02 -0.00 0.00 -0.00 0.00 0.00 59.98 60.13 3i05 h ARG 329 Cb 0.03 -0.08 -0.00 0.00 -0.00 0.00 0.00 29.97 29.92 3i05 h ARG 329 CO -0.03 0.23 -0.07 0.28 -0.00 0.00 0.00 179.97 180.37 3i05 h VAL 330 N 0.35 0.84 0.00 0.08 2.07 -1.20 -1.68 116.25 116.72 3i05 h VAL 330 Ca 0.14 0.00 -0.19 0.00 0.82 0.00 0.00 66.70 67.48 3i05 h VAL 330 Cb 0.06 0.84 0.01 0.00 -1.52 0.00 0.00 31.29 30.67 3i05 h VAL 330 CO -0.10 0.00 1.70 0.29 0.02 0.00 0.00 177.57 179.48 3i05 n LYS 331 N -5.18 1.06 0.00 1.57 5.02 0.13 -2.98 118.16 117.78 3i05 n LYS 331 Ca -0.08 -0.94 0.00 0.00 -2.02 0.00 0.00 58.31 55.27 3i05 n LYS 331 Cb 0.11 -2.18 0.00 0.00 -0.02 0.00 0.00 35.03 32.94 3i05 n LYS 331 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3i05 n LYS 332 N 4.41 0.00 -3.74 1.97 5.02 -1.22 -4.92 118.16 119.68 3i05 n LYS 332 Ca 0.23 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.32 3i05 n LYS 332 Cb 0.09 0.00 -0.17 0.00 -0.02 0.00 0.00 35.03 34.92 3i05 n LYS 332 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3i05 s GLU 333 N 0.00 0.14 0.00 1.97 2.02 -0.63 -4.40 118.70 117.79 3i05 s GLU 333 Ca 0.00 0.26 0.00 0.00 0.02 0.00 0.00 54.97 55.25 3i05 s GLU 333 Cb 0.00 -0.59 0.00 0.00 0.10 0.00 0.00 34.13 33.64 3i05 s GLU 333 CO 0.00 -0.29 0.00 0.41 0.02 0.00 0.00 175.26 175.40 3i05 n GLY 337 N 5.02 0.00 1.30 -1.39 0.00 -1.26 -3.94 105.19 104.92 3i05 n GLY 337 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 3i05 n GLY 337 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3i05 n ARG 338 N 1.39 0.00 -1.85 1.61 1.85 -1.26 -5.03 116.66 113.36 3i05 n ARG 338 Ca 0.00 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.43 3i05 n ARG 338 Cb 0.00 -0.33 -0.03 0.00 -1.05 0.00 0.00 32.46 31.05 3i05 n ARG 338 CO 0.00 0.00 0.00 0.96 -0.01 0.00 0.00 177.63 178.58 3i05 s ILE 339 N -1.89 2.66 0.53 8.89 -5.25 -1.26 -5.02 121.20 119.87 3i05 s ILE 339 Ca 0.00 0.31 -0.17 0.00 -0.99 0.00 0.00 60.65 59.81 3i05 s ILE 339 Cb 0.00 -3.20 -0.07 0.00 2.95 0.00 0.00 42.46 42.14 3i05 s ILE 339 CO 0.00 0.01 1.01 -0.32 -1.79 0.00 0.00 174.94 173.85 3i05 s MET 340 N 2.02 3.77 0.30 0.37 1.75 -1.26 -4.97 119.30 121.27 3i05 s MET 340 Ca 0.74 1.06 0.06 0.00 -1.25 0.00 0.00 55.69 56.30 3i05 s MET 340 Cb -0.44 -2.10 0.78 0.00 2.84 0.00 0.00 34.83 35.91 3i05 s MET 340 CO 0.33 -0.43 1.70 0.00 -0.65 0.00 0.00 175.02 175.96 3i05 h THR 341 N 0.86 0.46 0.00 10.11 1.03 -2.02 -2.56 112.91 120.80 3i05 h THR 341 Ca -0.47 -0.14 -0.10 0.00 -0.01 0.00 0.00 66.41 65.69 3i05 h THR 341 Cb 1.20 0.01 -0.01 0.00 -1.07 0.00 0.00 68.15 68.27 3i05 h THR 341 CO 0.60 0.08 -0.47 1.23 -0.01 0.00 0.00 175.52 176.95 3i05 h GLY 342 N 0.42 0.00 1.99 2.99 0.00 -2.00 -2.91 103.07 103.56 3i05 h GLY 342 Ca 0.59 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.79 3i05 h GLY 342 CO -0.53 0.00 -0.61 0.83 0.00 0.00 0.00 176.54 176.23 3i05 h GLU 343 N 0.00 0.01 0.31 4.80 5.08 -1.85 -2.58 114.58 120.35 3i05 h GLU 343 Ca -0.00 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3i05 h GLU 343 Cb 0.98 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 3i05 h GLU 343 CO 0.06 0.62 -0.22 0.28 -1.00 0.00 0.00 179.01 178.74 3i05 h VAL 344 N 0.01 0.52 -0.50 3.13 2.07 -1.46 -3.16 116.25 116.86 3i05 h VAL 344 Ca -0.01 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.57 3i05 h VAL 344 Cb 1.08 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.35 3i05 h VAL 344 CO 0.08 0.00 0.34 0.11 0.02 0.00 0.00 177.57 178.12 3i05 h LYS 345 N -0.53 0.43 -0.79 1.57 1.57 -1.36 0.11 116.57 117.57 3i05 h LYS 345 Ca -0.03 -0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.76 3i05 h LYS 345 Cb 0.46 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.63 3i05 h LYS 345 CO 0.01 0.28 0.50 -0.22 -0.57 0.00 0.00 179.45 179.45 3i05 h LYS 346 N 0.44 0.95 -0.38 3.15 3.64 -1.43 -0.86 116.57 122.08 3i05 h LYS 346 Ca 0.22 -0.06 -0.13 0.00 -1.27 0.00 0.00 60.65 59.41 3i05 h LYS 346 Cb 0.30 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 3i05 h LYS 346 CO -0.06 0.63 -0.26 1.25 -2.27 0.00 0.00 179.45 178.74 3i05 h LEU 347 N 0.98 0.88 -0.27 5.20 5.85 -0.76 -2.21 115.31 124.98 3i05 h LEU 347 Ca 0.32 -0.43 -0.04 0.00 0.84 0.00 0.00 57.88 58.57 3i05 h LEU 347 Cb 0.01 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 3i05 h LEU 347 CO -0.11 1.13 0.03 0.25 -0.34 0.00 0.00 178.44 179.39 3i05 h LEU 348 N 0.65 0.45 -1.33 2.25 5.85 -1.27 -2.02 115.31 119.89 3i05 h LEU 348 Ca 0.07 -0.28 -0.02 0.00 0.84 0.00 0.00 57.88 58.49 3i05 h LEU 348 Cb 0.83 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 3i05 h LEU 348 CO 0.07 0.62 0.21 0.40 -0.34 0.00 0.00 178.44 179.39 3i05 h ILE 349 N 0.26 1.17 -0.29 4.05 2.04 -1.16 -0.02 117.51 123.56 3i05 h ILE 349 Ca 0.08 -0.51 -0.06 0.00 1.00 0.00 0.00 64.86 65.38 3i05 h ILE 349 Cb 0.37 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 3i05 h ILE 349 CO 0.01 0.20 -0.04 0.78 0.00 0.00 0.00 178.15 179.10 3i05 h ASN 350 N 0.67 0.54 0.21 1.72 2.35 -1.22 -1.83 115.58 118.02 3i05 h ASN 350 Ca 0.17 -0.34 -0.21 0.00 -0.55 0.00 0.00 56.30 55.37 3i05 h ASN 350 Cb 0.11 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.33 3i05 h ASN 350 CO -0.02 0.75 -0.83 0.71 -1.65 0.00 0.00 177.43 176.39 3i05 h THR 351 N 0.32 1.37 -0.12 2.81 1.35 -1.00 -2.98 112.91 114.66 3i05 h THR 351 Ca 0.08 -2.23 -0.04 0.00 -0.55 0.00 0.00 66.41 63.68 3i05 h THR 351 Cb 0.50 2.21 -0.00 0.00 -1.73 0.00 0.00 68.15 69.13 3i05 h THR 351 CO 0.02 0.67 -0.07 0.40 -0.25 0.00 0.00 175.52 176.30 3i05 h ILE 352 N 0.31 1.32 -0.64 6.82 2.04 -1.06 -2.94 117.51 123.36 3i05 h ILE 352 Ca -0.06 -1.12 0.12 0.00 1.00 0.00 0.00 64.86 64.81 3i05 h ILE 352 Cb 1.44 1.81 -0.12 0.00 -0.74 0.00 0.00 36.82 39.21 3i05 h ILE 352 CO 0.15 0.32 -0.22 0.74 0.00 0.00 0.00 178.15 179.14 3i05 h THR 353 N -0.11 0.28 0.24 -0.27 2.02 -1.35 -0.08 112.91 113.63 3i05 h THR 353 Ca 0.03 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.21 3i05 h THR 353 Cb 0.54 0.28 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 3i05 h THR 353 CO 0.02 0.00 -0.38 0.00 0.37 0.00 0.00 175.52 175.53 3i05 h ALA 354 N 1.45 -0.74 -0.55 6.16 0.00 -1.54 0.48 119.26 124.53 3i05 h ALA 354 Ca 0.29 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 55.22 3i05 h ALA 354 Cb 0.51 0.60 -0.11 0.00 0.00 0.00 0.00 17.79 18.79 3i05 h ALA 354 CO -0.69 -0.97 -0.24 0.82 0.00 0.00 0.00 179.25 178.18 3i05 h ILE 355 N -0.69 0.29 0.10 0.00 2.04 -1.06 0.61 117.51 118.81 3i05 h ILE 355 Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 3i05 h ILE 355 Cb 0.67 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 37.04 3i05 h ILE 355 CO -0.15 0.00 -0.05 0.71 0.00 0.00 0.00 178.15 178.66 3i05 h THR 356 N -0.10 1.02 -0.65 -0.27 1.35 -0.74 -0.37 112.91 113.15 3i05 h THR 356 Ca 0.25 -0.48 0.06 0.00 -0.55 0.00 0.00 66.41 65.69 3i05 h THR 356 Cb 0.50 1.33 -0.06 0.00 -1.73 0.00 0.00 68.15 68.19 3i05 h THR 356 CO -0.62 0.12 0.35 0.11 -0.25 0.00 0.00 175.52 175.23 3i05 h LYS 357 N -0.36 0.63 -0.51 4.72 6.56 0.74 0.50 116.57 128.86 3i05 h LYS 357 Ca -0.01 -0.04 -0.01 0.00 -1.06 0.00 0.00 60.65 59.53 3i05 h LYS 357 Cb 0.30 -0.14 -0.02 0.00 -0.57 0.00 0.00 32.23 31.79 3i05 h LYS 357 CO 0.02 0.42 0.28 1.15 -2.06 0.00 0.00 179.45 179.26 3i05 h THR 358 N 0.65 1.17 -0.54 -0.16 2.02 0.28 0.11 112.91 116.45 3i05 h THR 358 Ca 0.29 -0.45 -0.08 0.00 0.77 0.00 0.00 66.41 66.95 3i05 h THR 358 Cb 0.20 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.13 3i05 h THR 358 CO -0.19 0.19 0.04 -0.74 0.37 0.00 0.00 175.52 175.19 3i05 h HIS 359 N 0.68 1.00 -0.54 3.16 6.17 0.33 0.62 115.15 126.56 3i05 h HIS 359 Ca 0.18 -0.16 -0.04 0.00 0.71 0.00 0.00 60.37 61.06 3i05 h HIS 359 Cb 0.05 -0.27 -0.02 0.00 2.52 0.00 0.00 27.41 29.69 3i05 h HIS 359 CO -0.02 0.91 0.18 1.96 0.71 0.00 0.00 177.93 181.67 3i05 h GLN 360 N 0.81 0.84 -0.63 5.26 4.20 0.15 0.62 115.11 126.36 3i05 h GLN 360 Ca 0.16 -0.17 -0.06 0.00 0.06 0.00 0.00 58.65 58.64 3i05 h GLN 360 Cb 0.48 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.11 3i05 h GLN 360 CO 0.02 0.76 0.16 0.93 -0.67 0.00 0.00 178.83 180.02 3i05 h GLU 361 N 0.75 0.99 -0.03 1.46 5.08 -0.50 -2.71 114.58 119.61 3i05 h GLU 361 Ca 0.18 -0.22 -0.18 0.00 -1.00 0.00 0.00 59.36 58.14 3i05 h GLU 361 Cb 0.26 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3i05 h GLU 361 CO -0.01 0.88 -0.76 1.57 -1.00 0.00 0.00 179.01 179.69 3i05 h LYS 362 N 0.94 0.22 -0.51 2.33 -0.00 -0.51 -3.28 116.57 115.76 3i05 h LYS 362 Ca 0.20 -0.20 -0.11 0.00 -0.00 0.00 0.00 60.65 60.54 3i05 h LYS 362 Cb 0.33 0.05 -0.02 0.00 -0.00 0.00 0.00 32.23 32.59 3i05 h LYS 362 CO -0.00 0.88 -0.12 -0.09 -0.00 0.00 0.00 179.45 180.12 3i05 h ARG 363 N 0.15 0.96 0.00 0.07 2.43 -0.56 -2.68 114.38 114.74 3i05 h ARG 363 Ca -0.03 -0.35 0.00 0.00 -0.81 0.00 0.00 59.98 58.79 3i05 h ARG 363 Cb 1.33 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.82 3i05 h ARG 363 CO 0.12 1.02 0.00 0.36 -1.51 0.00 0.00 179.97 179.96 3i05 n LYS 364 N -4.14 0.02 0.00 0.20 2.85 -1.13 -1.28 118.16 114.68 3i05 n LYS 364 Ca 0.01 0.37 0.10 0.00 -1.05 0.00 0.00 58.31 57.75 3i05 n LYS 364 Cb 0.40 -1.54 -0.09 0.00 -0.65 0.00 0.00 35.03 33.16 3i05 n LYS 364 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 3i05 n LEU 365 N -1.57 1.17 -4.71 -5.58 7.99 -1.01 -4.92 117.00 108.37 3i05 n LEU 365 Ca 0.02 -0.53 -0.42 0.00 -0.01 0.00 0.00 56.01 55.07 3i05 n LEU 365 Cb 0.10 -0.01 -0.03 0.00 -0.11 0.00 0.00 43.42 43.37 3i05 n LEU 365 CO 0.08 0.27 1.21 -0.69 -1.51 0.00 0.00 177.39 176.76 3i05 s VAL 366 N -2.90 3.01 0.40 4.08 1.01 -0.40 -5.00 120.40 120.58 3i05 s VAL 366 Ca 0.10 0.63 0.08 0.00 0.00 0.00 0.00 61.98 62.78 3i05 s VAL 366 Cb 0.16 -3.40 -0.07 0.00 0.00 0.00 0.00 36.38 33.07 3i05 s VAL 366 CO 0.81 0.03 0.04 0.42 0.00 0.00 0.00 175.10 176.40 3i05 s THR 367 N 1.74 2.15 0.45 3.92 -4.23 -1.26 -5.03 115.64 113.39 3i05 s THR 367 Ca 0.70 -1.94 0.20 0.00 -1.18 0.00 0.00 61.69 59.46 3i05 s THR 367 Cb -0.40 -2.95 0.24 0.00 1.34 0.00 0.00 72.50 70.73 3i05 s THR 367 CO 0.31 -0.04 2.04 0.44 -0.54 0.00 0.00 174.62 176.83 3i05 h ASP 368 N 1.71 0.00 0.51 3.99 3.32 -2.00 -1.02 116.42 122.94 3i05 h ASP 368 Ca -0.43 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.47 3i05 h ASP 368 Cb 1.25 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.78 3i05 h ASP 368 CO 0.76 0.15 -0.64 -0.33 -1.72 0.00 0.00 179.24 177.46 3i05 h GLU 369 N 0.00 0.11 -0.26 3.56 3.07 -1.99 -2.05 114.58 117.03 3i05 h GLU 369 Ca -0.00 -0.08 -0.02 0.00 -0.50 0.00 0.00 59.36 58.75 3i05 h GLU 369 Cb 0.30 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.21 3i05 h GLU 369 CO 0.02 0.71 0.07 -0.44 -1.40 0.00 0.00 179.01 177.97 3i05 h ASP 370 N 0.08 0.39 0.01 1.42 3.32 -1.60 0.26 116.42 120.30 3i05 h ASP 370 Ca -0.01 -0.22 0.03 0.00 0.02 0.00 0.00 57.03 56.85 3i05 h ASP 370 Cb 1.14 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 40.55 3i05 h ASP 370 CO 0.09 0.50 -0.20 0.58 -1.72 0.00 0.00 179.24 178.50 3i05 h VAL 371 N 0.26 0.54 -0.93 -1.35 2.07 -1.41 0.91 116.25 116.34 3i05 h VAL 371 Ca 0.08 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.68 3i05 h VAL 371 Cb 0.26 0.54 -0.07 0.00 -1.52 0.00 0.00 31.29 30.50 3i05 h VAL 371 CO -0.00 0.00 0.58 1.56 0.02 0.00 0.00 177.57 179.73 3i05 h GLN 372 N -0.32 1.00 0.26 1.57 4.20 -1.15 -1.20 115.11 119.47 3i05 h GLN 372 Ca 0.06 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 3i05 h GLN 372 Cb 0.39 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 27.95 3i05 h GLN 372 CO -0.18 0.66 -0.12 1.25 -0.67 0.00 0.00 178.83 179.77 3i05 h LEU 373 N 1.03 -0.29 -1.71 1.46 5.85 0.22 -0.03 115.31 121.84 3i05 h LEU 373 Ca 0.42 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.99 3i05 h LEU 373 Cb 0.23 0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.34 3i05 h LEU 373 CO -0.19 -0.06 -0.15 -0.26 -0.34 0.00 0.00 178.44 177.43 3i05 h PHE 374 N -0.52 0.00 0.00 1.25 0.04 -0.62 -2.81 116.94 114.28 3i05 h PHE 374 Ca -0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.73 3i05 h PHE 374 Cb 0.39 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.54 3i05 h PHE 374 CO -0.01 0.15 -0.63 1.79 -0.60 0.00 0.00 178.31 179.01 3i05 h THR 375 N 0.00 0.00 -4.29 -1.55 1.35 -0.98 -2.78 112.91 104.66 3i05 h THR 375 Ca -0.00 -0.90 -0.52 0.00 -0.55 0.00 0.00 66.41 64.44 3i05 h THR 375 Cb 0.27 1.56 0.16 0.00 -1.73 0.00 0.00 68.15 68.42 3i05 h THR 375 CO 0.02 0.00 0.27 -0.94 -0.25 0.00 0.00 175.52 174.62 3i05 s SER 376 N -5.37 3.72 -0.51 5.36 1.04 -0.05 -4.85 113.70 113.04 3i05 s SER 376 Ca 0.03 2.01 0.00 0.00 0.48 0.00 0.00 55.95 58.48 3i05 s SER 376 Cb 0.09 -2.54 0.47 0.00 0.10 0.00 0.00 66.02 64.14 3i05 s SER 376 CO 0.74 -2.57 1.94 0.35 0.98 0.00 0.00 173.24 174.68 3i05 n THR 377 N -3.86 3.22 -0.91 2.02 -2.24 -1.26 -4.96 114.28 106.29 3i05 n THR 377 Ca 0.10 -2.23 -0.33 0.00 -2.27 0.00 0.00 64.05 59.33 3i05 n THR 377 Cb 0.52 -0.92 0.14 0.00 -2.10 0.00 0.00 70.33 67.97 3i05 n THR 377 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 3i05 n ARG 378 N -0.75 -0.11 -1.90 -0.78 -4.01 -1.26 -4.90 116.66 102.95 3i05 n ARG 378 Ca 0.54 0.04 -0.42 0.00 -1.04 0.00 0.00 57.85 56.97 3i05 n ARG 378 Cb 1.01 -2.32 -0.02 0.00 -3.04 0.00 0.00 32.46 28.08 3i05 n ARG 378 CO 0.00 0.00 0.00 0.42 -3.04 0.00 0.00 177.63 175.01 3i05 s ILE 379 N -2.34 2.42 0.13 8.89 -1.09 -1.26 -4.76 121.20 123.19 3i05 s ILE 379 Ca 0.69 0.33 -0.09 0.00 -2.23 0.00 0.00 60.65 59.35 3i05 s ILE 379 Cb -0.26 -3.21 -0.01 0.00 -1.58 0.00 0.00 42.46 37.40 3i05 s ILE 379 CO 0.56 0.04 0.24 -0.04 -1.23 0.00 0.00 174.94 174.51 3i05 s MET 380 N 0.12 1.03 3.63 2.79 -1.94 -1.01 -5.02 119.30 118.90 3i05 s MET 380 Ca 0.65 -1.09 0.00 0.00 -1.71 0.00 0.00 55.69 53.53 3i05 s MET 380 Cb -0.45 0.36 0.00 0.00 2.01 0.00 0.00 34.83 36.75 3i05 s MET 380 CO 0.40 -0.36 0.00 0.41 -0.01 0.00 0.00 175.02 175.46 3i05 n GLY 381 N -0.15 2.65 0.22 -0.03 0.00 -1.26 -2.22 105.19 104.39 3i05 n GLY 381 Ca -0.10 -0.18 0.09 0.00 0.00 0.00 0.00 46.02 45.83 3i05 n GLY 381 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3i05 h PRO 382 N 0.00 0.00 -2.94 1.61 0.11 -1.95 -2.73 132.00 126.09 3i05 h PRO 382 Ca 0.00 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.53 3i05 h PRO 382 Cb 0.00 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.13 3i05 h PRO 382 CO 0.00 0.00 3.22 0.00 -0.21 0.00 0.00 178.00 181.01 3i05 n ALA 383 N -1.66 7.06 0.01 -0.75 0.00 -0.94 -4.15 120.51 120.07 3i05 n ALA 383 Ca -0.01 -3.13 0.03 0.00 0.00 0.00 0.00 53.44 50.32 3i05 n ALA 383 Cb 0.37 -3.21 -0.11 0.00 0.00 0.00 0.00 19.45 16.51 3i05 n ALA 383 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 3i05 n LYS 384 N 3.53 0.64 0.00 0.00 0.00 -1.03 -4.29 118.16 117.01 3i05 n LYS 384 Ca 0.70 0.05 0.00 0.00 -0.00 0.00 0.00 58.31 59.07 3i05 n LYS 384 Cb 0.29 -1.68 0.00 0.00 -0.00 0.00 0.00 35.03 33.64 3i05 n LYS 384 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03