#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xi9 s ARG 3 N 0.00 3.74 0.70 0.38 1.81 -1.26 -5.09 118.95 119.23 1xi9 s ARG 3 Ca 0.00 -0.07 -0.11 0.00 -1.72 0.00 0.00 55.73 53.82 1xi9 s ARG 3 Cb 0.00 -3.27 0.02 0.00 -0.45 0.00 0.00 34.95 31.25 1xi9 s ARG 3 CO 0.00 0.61 1.07 0.00 -0.68 0.00 0.00 175.30 176.30 1xi9 s ALA 4 N -0.57 2.58 0.49 2.13 0.00 -1.26 -5.01 121.76 120.12 1xi9 s ALA 4 Ca 0.14 0.17 -0.23 0.00 0.00 0.00 0.00 51.96 52.04 1xi9 s ALA 4 Cb -0.12 -3.21 -0.06 0.00 0.00 0.00 0.00 23.12 19.73 1xi9 s ALA 4 CO 0.04 -1.32 1.28 -1.54 0.00 0.00 0.00 175.76 174.22 1xi9 s SER 5 N -3.58 5.77 0.11 0.00 1.04 -1.26 -4.93 113.70 110.84 1xi9 s SER 5 Ca 0.59 2.59 -0.22 0.00 0.48 0.00 0.00 55.95 59.40 1xi9 s SER 5 Cb -0.15 -2.62 -0.09 0.00 0.10 0.00 0.00 66.02 63.26 1xi9 s SER 5 CO 0.53 -1.21 1.72 0.07 0.98 0.00 0.00 173.24 175.32 1xi9 h LYS 6 N 1.89 -0.04 -0.53 4.02 -0.00 -2.00 -2.57 116.57 117.34 1xi9 h LYS 6 Ca -0.50 0.00 0.10 0.00 -0.00 0.00 0.00 60.65 60.25 1xi9 h LYS 6 Cb 1.27 0.01 -0.08 0.00 -0.00 0.00 0.00 32.23 33.43 1xi9 h LYS 6 CO 0.59 -0.02 0.08 0.07 -0.00 0.00 0.00 179.45 180.17 1xi9 h ARG 7 N -0.04 0.20 -0.35 0.07 -0.00 -1.91 -2.09 114.38 110.26 1xi9 h ARG 7 Ca 0.05 -0.01 -0.07 0.00 -0.00 0.00 0.00 59.98 59.95 1xi9 h ARG 7 Cb 0.11 -0.05 -0.02 0.00 -0.00 0.00 0.00 29.97 30.02 1xi9 h ARG 7 CO -0.11 0.13 -0.07 0.00 -0.00 0.00 0.00 179.97 179.93 1xi9 h ALA 8 N 1.43 1.23 -0.24 0.08 0.00 -1.85 -3.06 119.26 116.86 1xi9 h ALA 8 Ca 0.27 -0.26 -0.17 0.00 0.00 0.00 0.00 54.91 54.75 1xi9 h ALA 8 Cb 0.39 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1xi9 h ALA 8 CO -0.38 0.51 -0.55 -0.07 0.00 0.00 0.00 179.25 178.76 1xi9 h LEU 9 N 0.55 0.80 0.00 0.00 3.38 -1.09 -3.11 115.31 115.83 1xi9 h LEU 9 Ca 0.11 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1xi9 h LEU 9 Cb 0.45 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1xi9 h LEU 9 CO 0.02 1.19 0.00 -1.54 0.09 0.00 0.00 178.44 178.20 1xi9 n SER 10 N -3.98 0.00 -4.50 -0.43 3.41 -0.82 -4.64 113.62 102.66 1xi9 n SER 10 Ca -0.04 -0.32 -0.42 0.00 -0.26 0.00 0.00 58.87 57.83 1xi9 n SER 10 Cb 0.62 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.48 1xi9 n SER 10 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1xi9 s VAL 11 N -2.00 5.15 0.39 -3.33 1.01 -1.18 -4.95 120.40 115.49 1xi9 s VAL 11 Ca 0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 61.79 1xi9 s VAL 11 Cb 0.05 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 1xi9 s VAL 11 CO 0.08 -0.28 0.62 -1.61 0.00 0.00 0.00 175.10 173.91 1xi9 s GLU 12 N 2.00 3.49 0.00 2.72 0.41 -1.26 -5.08 118.70 120.97 1xi9 s GLU 12 Ca 0.10 -0.19 0.00 0.00 -0.41 0.00 0.00 54.97 54.47 1xi9 s GLU 12 Cb -0.17 -2.58 0.00 0.00 -1.78 0.00 0.00 34.13 29.60 1xi9 s GLU 12 CO 0.12 0.03 0.00 -0.35 -0.49 0.00 0.00 175.26 174.58 1xi9 n PRO 21 N -1.93 0.00 0.15 0.39 -0.04 -1.26 -4.84 135.00 127.47 1xi9 n PRO 21 Ca -0.03 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.52 1xi9 n PRO 21 Cb 0.56 0.00 0.07 0.00 -0.04 0.00 0.00 33.50 34.09 1xi9 n PRO 21 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1xi9 h ALA 22 N 0.00 0.74 -0.15 0.55 0.00 -2.00 -3.26 119.26 115.15 1xi9 h ALA 22 Ca 0.00 -0.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.57 1xi9 h ALA 22 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1xi9 h ALA 22 CO 0.00 0.16 -0.74 0.07 0.00 0.00 0.00 179.25 178.74 1xi9 h ARG 23 N 0.00 0.69 -0.06 0.00 0.11 -2.00 0.42 114.38 113.54 1xi9 h ARG 23 Ca -0.02 -0.54 -0.02 0.00 0.10 0.00 0.00 59.98 59.50 1xi9 h ARG 23 Cb 1.10 0.11 -0.01 0.00 1.11 0.00 0.00 29.97 32.28 1xi9 h ARG 23 CO 0.01 1.16 -0.07 1.49 0.10 0.00 0.00 179.97 182.67 1xi9 h GLU 24 N 0.48 0.09 -0.00 0.08 4.81 -2.00 -0.35 114.58 117.69 1xi9 h GLU 24 Ca -0.04 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 1xi9 h GLU 24 Cb 1.35 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.71 1xi9 h GLU 24 CO 0.15 0.16 -0.02 -0.07 -0.73 0.00 0.00 179.01 178.50 1xi9 h LEU 25 N 0.09 0.02 -1.52 1.64 3.38 -1.54 -3.31 115.31 114.07 1xi9 h LEU 25 Ca 0.02 -0.75 -0.05 0.00 0.09 0.00 0.00 57.88 57.19 1xi9 h LEU 25 Cb 0.18 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1xi9 h LEU 25 CO 0.01 0.77 -0.24 -0.33 0.09 0.00 0.00 178.44 178.74 1xi9 h GLU 26 N -0.72 0.00 0.00 1.13 5.08 -0.70 -1.78 114.58 117.60 1xi9 h GLU 26 Ca -0.00 -0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 1xi9 h GLU 26 Cb 0.77 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 1xi9 h GLU 26 CO 0.00 0.24 -0.24 1.57 -1.00 0.00 0.00 179.01 179.58 1xi9 h LYS 27 N 0.00 0.00 0.00 2.33 -0.00 -1.21 -2.47 116.57 115.22 1xi9 h LYS 27 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.65 1xi9 h LYS 27 Cb 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.66 1xi9 h LYS 27 CO 0.03 0.24 0.00 0.87 -0.00 0.00 0.00 179.45 180.59 1xi9 h LYS 28 N 0.00 0.00 0.00 0.07 1.57 -1.41 -3.47 116.57 113.33 1xi9 h LYS 28 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1xi9 h LYS 28 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.02 1xi9 h LYS 28 CO 0.03 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.32 1xi9 n GLY 29 N 0.75 0.90 3.71 3.86 0.00 -0.93 -5.09 105.19 108.38 1xi9 n GLY 29 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1xi9 n GLY 29 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xi9 s ILE 30 N -2.00 4.23 -0.34 -0.61 1.01 -1.05 -5.01 121.20 117.43 1xi9 s ILE 30 Ca 0.00 1.59 -0.18 0.00 0.00 0.00 0.00 60.65 62.06 1xi9 s ILE 30 Cb 0.00 -4.02 -0.01 0.00 0.01 0.00 0.00 42.46 38.45 1xi9 s ILE 30 CO 0.00 0.10 0.52 -1.59 0.00 0.00 0.00 174.94 173.97 1xi9 s LYS 31 N 1.29 3.66 -0.08 2.79 0.00 -1.26 -3.78 119.74 122.36 1xi9 s LYS 31 Ca 0.57 -0.11 -0.15 0.00 0.00 0.00 0.00 55.97 56.28 1xi9 s LYS 31 Cb -0.27 -3.80 -0.05 0.00 0.00 0.00 0.00 37.83 33.72 1xi9 s LYS 31 CO 0.27 -0.62 0.39 0.14 0.00 0.00 0.00 175.35 175.53 1xi9 s VAL 32 N 2.41 5.16 -0.36 1.79 -7.23 -1.26 -4.96 120.40 115.93 1xi9 s VAL 32 Ca 0.19 0.79 -0.29 0.00 -1.81 0.00 0.00 61.98 60.86 1xi9 s VAL 32 Cb -0.15 -3.71 0.01 0.00 0.56 0.00 0.00 36.38 33.08 1xi9 s VAL 32 CO 0.13 0.46 1.23 -0.63 -0.31 0.00 0.00 175.10 175.98 1xi9 s ILE 33 N -0.21 4.20 -0.47 -0.62 1.01 -0.47 -4.94 121.20 119.71 1xi9 s ILE 33 Ca 0.22 1.32 -0.20 0.00 0.00 0.00 0.00 60.65 62.00 1xi9 s ILE 33 Cb -0.15 -4.33 0.04 0.00 0.01 0.00 0.00 42.46 38.03 1xi9 s ILE 33 CO 0.10 -0.65 0.61 -0.13 0.00 0.00 0.00 174.94 174.87 1xi9 s ARG 34 N 4.24 3.18 -0.12 2.79 0.52 -1.26 -0.53 118.95 127.77 1xi9 s ARG 34 Ca 0.53 -0.67 0.15 0.00 -0.52 0.00 0.00 55.73 55.22 1xi9 s ARG 34 Cb -0.13 -4.02 0.35 0.00 0.52 0.00 0.00 34.95 31.67 1xi9 s ARG 34 CO 0.25 -1.09 1.25 1.28 0.02 0.00 0.00 175.30 177.01 1xi9 n LEU 35 N 6.15 2.99 0.03 2.53 4.77 -0.28 -4.61 117.00 128.57 1xi9 n LEU 35 Ca -0.05 -2.81 0.11 0.00 -0.03 0.00 0.00 56.01 53.24 1xi9 n LEU 35 Cb 0.47 -0.40 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 1xi9 n LEU 35 CO 0.53 0.67 -0.15 -0.46 -1.33 0.00 0.00 177.39 176.65 1xi9 n ASN 36 N -0.73 0.55 -4.45 -1.43 6.94 -1.04 -1.05 115.26 114.05 1xi9 n ASN 36 Ca 0.16 -0.17 -0.36 0.00 -0.02 0.00 0.00 54.58 54.19 1xi9 n ASN 36 Cb 0.67 1.00 -0.13 0.00 -2.36 0.00 0.00 39.78 38.97 1xi9 n ASN 36 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 1xi9 s ILE 37 N -3.26 4.32 -0.07 1.53 -4.36 -1.26 -4.86 121.20 113.24 1xi9 s ILE 37 Ca 0.01 -0.17 0.01 0.00 -0.26 0.00 0.00 60.65 60.24 1xi9 s ILE 37 Cb 0.14 -3.02 0.10 0.00 1.25 0.00 0.00 42.46 40.93 1xi9 s ILE 37 CO 0.83 0.34 1.16 0.61 0.24 0.00 0.00 174.94 178.11 1xi9 n GLY 38 N 4.92 2.39 3.29 6.27 0.00 -1.26 -4.80 105.19 116.00 1xi9 n GLY 38 Ca -0.16 -0.17 -0.40 0.00 0.00 0.00 0.00 46.02 45.29 1xi9 n GLY 38 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xi9 s ASP 39 N 0.68 5.65 0.46 1.61 -1.08 -1.26 -4.96 116.67 117.77 1xi9 s ASP 39 Ca 0.09 -1.42 0.12 0.00 -0.52 0.00 0.00 52.55 50.82 1xi9 s ASP 39 Cb 0.07 -1.99 1.06 0.00 -1.46 0.00 0.00 42.92 40.60 1xi9 s ASP 39 CO 0.02 -0.51 2.08 1.55 0.52 0.00 0.00 175.17 178.82 1xi9 h PRO 40 N 8.41 0.20 0.00 4.34 0.13 -1.90 -2.33 132.00 140.85 1xi9 h PRO 40 Ca -0.23 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1xi9 h PRO 40 Cb 1.09 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1xi9 h PRO 40 CO 0.74 0.17 0.00 0.28 -0.23 0.00 0.00 178.00 178.96 1xi9 n VAL 41 N -4.47 0.88 1.18 1.56 0.31 -1.26 -1.16 118.33 115.38 1xi9 n VAL 41 Ca -0.01 0.22 0.14 0.00 -0.01 0.00 0.00 64.34 64.68 1xi9 n VAL 41 Cb 0.11 -1.00 0.66 0.00 -0.91 0.00 0.00 33.84 32.70 1xi9 n VAL 41 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1xi9 n LYS 42 N -1.71 0.19 0.00 5.55 4.76 -0.88 -4.73 118.16 121.34 1xi9 n LYS 42 Ca 0.03 -0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.46 1xi9 n LYS 42 Cb 0.20 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.89 1xi9 n LYS 42 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 1xi9 n PHE 43 N -1.40 0.00 -1.25 2.13 3.72 -0.31 -4.99 117.46 115.36 1xi9 n PHE 43 Ca 0.10 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.29 1xi9 n PHE 43 Cb 0.30 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.78 1xi9 n PHE 43 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1xi9 n ASP 44 N 0.00 6.19 -3.94 4.37 3.85 -1.26 -4.86 116.55 120.90 1xi9 n ASP 44 Ca 0.00 -3.01 -0.15 0.00 -0.71 0.00 0.00 54.79 50.92 1xi9 n ASP 44 Cb 0.00 -1.24 -0.14 0.00 -1.35 0.00 0.00 41.12 38.39 1xi9 n ASP 44 CO 0.00 0.00 0.00 -0.36 -1.01 0.00 0.00 177.20 175.83 1xi9 s PHE 45 N -1.14 0.39 0.03 2.11 0.40 -1.25 -5.09 117.98 113.43 1xi9 s PHE 45 Ca 0.53 -0.07 -0.08 0.00 -0.60 0.00 0.00 56.93 56.71 1xi9 s PHE 45 Cb 0.33 -0.26 0.00 0.00 0.51 0.00 0.00 43.02 43.61 1xi9 s PHE 45 CO -0.13 -0.01 0.16 -0.65 0.70 0.00 0.00 175.22 175.29 1xi9 s GLN 46 N -0.06 0.63 0.44 0.44 -1.52 -1.26 -4.16 119.66 114.17 1xi9 s GLN 46 Ca 0.01 -0.60 -0.26 0.00 -1.95 0.00 0.00 55.36 52.56 1xi9 s GLN 46 Cb -0.02 0.26 -0.09 0.00 -0.22 0.00 0.00 33.01 32.94 1xi9 s GLN 46 CO -0.00 -0.17 1.46 -0.35 -0.25 0.00 0.00 175.29 175.97 1xi9 n PRO 47 N 0.87 2.36 -1.34 2.91 -0.04 -0.99 -4.79 135.00 133.99 1xi9 n PRO 47 Ca -0.20 0.84 -0.35 0.00 -0.04 0.00 0.00 63.50 63.75 1xi9 n PRO 47 Cb 0.58 -2.66 0.09 0.00 -0.04 0.00 0.00 33.50 31.48 1xi9 n PRO 47 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1xi9 n PRO 48 N -0.07 0.50 -0.29 0.54 -0.04 -1.26 -4.72 135.00 129.66 1xi9 n PRO 48 Ca 0.04 0.23 0.07 0.00 -0.04 0.00 0.00 63.50 63.80 1xi9 n PRO 48 Cb 0.41 -2.30 0.22 0.00 -0.04 0.00 0.00 33.50 31.79 1xi9 n PRO 48 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1xi9 h GLU 49 N -0.32 0.57 0.00 0.54 4.57 -2.00 -1.27 114.58 116.66 1xi9 h GLU 49 Ca -0.47 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 57.66 1xi9 h GLU 49 Cb 1.33 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 29.79 1xi9 h GLU 49 CO 0.47 0.38 -0.03 1.12 -1.18 0.00 0.00 179.01 179.77 1xi9 h HIS 50 N 0.59 0.00 0.18 0.92 2.07 -1.97 -0.54 115.15 116.39 1xi9 h HIS 50 Ca 0.46 0.00 -0.28 0.00 -2.85 0.00 0.00 60.37 57.70 1xi9 h HIS 50 Cb 0.66 0.00 0.02 0.00 2.57 0.00 0.00 27.41 30.66 1xi9 h HIS 50 CO -0.10 0.03 -1.29 0.52 -3.07 0.00 0.00 177.93 174.02 1xi9 h MET 51 N 0.00 0.39 -0.61 5.12 2.86 -1.54 -2.95 114.93 118.19 1xi9 h MET 51 Ca -0.00 -0.66 0.04 0.00 -2.06 0.00 0.00 59.70 57.02 1xi9 h MET 51 Cb 0.38 0.25 -0.05 0.00 0.06 0.00 0.00 31.60 32.24 1xi9 h MET 51 CO 0.00 1.32 0.36 0.87 1.06 0.00 0.00 176.91 180.52 1xi9 h LYS 52 N -0.11 0.66 -0.21 1.72 1.57 -1.10 -2.00 116.57 117.11 1xi9 h LYS 52 Ca -0.24 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.50 1xi9 h LYS 52 Cb 1.91 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 34.06 1xi9 h LYS 52 CO 0.18 0.44 0.12 1.49 -0.57 0.00 0.00 179.45 181.11 1xi9 h GLU 53 N 0.68 0.29 -0.18 3.15 4.57 -1.22 -1.80 114.58 120.08 1xi9 h GLU 53 Ca 0.26 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.41 1xi9 h GLU 53 Cb 0.10 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.62 1xi9 h GLU 53 CO -0.14 0.26 0.12 0.00 -1.18 0.00 0.00 179.01 178.07 1xi9 h ALA 54 N 1.02 0.22 0.24 2.92 0.00 -1.40 0.47 119.26 122.73 1xi9 h ALA 54 Ca 0.08 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1xi9 h ALA 54 Cb 0.05 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1xi9 h ALA 54 CO -0.01 -0.29 -0.39 -0.92 0.00 0.00 0.00 179.25 177.63 1xi9 h TYR 55 N 0.24 -1.09 -0.87 0.00 5.03 -1.31 0.19 116.97 119.16 1xi9 h TYR 55 Ca 0.06 0.02 0.02 0.00 2.58 0.00 0.00 58.73 61.41 1xi9 h TYR 55 Cb -0.02 0.44 -0.05 0.00 1.55 0.00 0.00 36.73 38.65 1xi9 h TYR 55 CO -0.07 -0.52 0.58 0.00 -1.32 0.00 0.00 178.16 176.83 1xi9 h LYS 57 N 1.16 0.96 -0.30 0.00 3.64 0.22 -2.41 116.57 119.84 1xi9 h LYS 57 Ca 0.33 -0.13 0.06 0.00 -1.27 0.00 0.00 60.65 59.64 1xi9 h LYS 57 Cb -0.10 -0.18 -0.06 0.00 -0.41 0.00 0.00 32.23 31.48 1xi9 h LYS 57 CO -0.08 0.74 -0.08 0.00 -2.27 0.00 0.00 179.45 177.76 1xi9 h ALA 58 N 1.16 0.19 0.64 5.00 0.00 -0.16 0.19 119.26 126.28 1xi9 h ALA 58 Ca 0.23 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 1xi9 h ALA 58 Cb 0.09 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1xi9 h ALA 58 CO -0.03 -0.47 -0.44 0.82 0.00 0.00 0.00 179.25 179.13 1xi9 h ILE 59 N -0.01 0.12 -0.90 0.00 2.04 -1.33 -0.74 117.51 116.69 1xi9 h ILE 59 Ca 0.15 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.08 1xi9 h ILE 59 Cb 0.23 0.12 -0.06 0.00 -0.74 0.00 0.00 36.82 36.38 1xi9 h ILE 59 CO -0.32 0.00 0.58 0.11 0.00 0.00 0.00 178.15 178.52 1xi9 h LYS 60 N -1.02 0.95 0.00 2.37 1.57 -1.35 -1.86 116.57 117.22 1xi9 h LYS 60 Ca -0.08 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1xi9 h LYS 60 Cb 0.84 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.94 1xi9 h LYS 60 CO 0.05 0.63 0.00 0.39 -0.57 0.00 0.00 179.45 179.95 1xi9 n GLU 61 N -4.50 0.93 -0.13 3.15 1.02 0.65 -4.88 120.64 116.88 1xi9 n GLU 61 Ca 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 1xi9 n GLU 61 Cb 0.24 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.21 1xi9 n GLU 61 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xi9 n GLY 62 N 0.82 0.93 2.62 0.62 0.00 -0.70 -4.99 105.19 104.49 1xi9 n GLY 62 Ca 0.20 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1xi9 n GLY 62 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1xi9 n HIS 63 N -2.13 2.99 -0.58 1.61 8.25 -0.33 -4.45 115.22 120.59 1xi9 n HIS 63 Ca 0.00 -2.95 0.02 0.00 -0.26 0.00 0.00 57.72 54.54 1xi9 n HIS 63 Cb 0.00 -2.31 0.03 0.00 1.12 0.00 0.00 29.99 28.83 1xi9 n HIS 63 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1xi9 n ASN 64 N 4.36 1.55 -4.95 0.41 3.02 -1.26 -3.49 115.26 114.90 1xi9 n ASN 64 Ca 0.58 -2.05 -0.22 0.00 -0.03 0.00 0.00 54.58 52.86 1xi9 n ASN 64 Cb 0.32 -0.11 0.05 0.00 -0.61 0.00 0.00 39.78 39.43 1xi9 n ASN 64 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 1xi9 s TYR 65 N -1.15 2.76 0.11 3.10 1.13 -1.26 -5.02 117.35 117.02 1xi9 s TYR 65 Ca 0.07 0.01 -0.31 0.00 -1.41 0.00 0.00 57.07 55.43 1xi9 s TYR 65 Cb 0.06 -2.81 -0.08 0.00 -1.10 0.00 0.00 41.96 38.03 1xi9 s TYR 65 CO 0.01 -0.99 1.50 0.71 -2.51 0.00 0.00 175.55 174.26 1xi9 s TYR 66 N -2.83 3.00 0.73 -3.49 4.12 -1.26 -4.63 117.35 112.99 1xi9 s TYR 66 Ca 0.58 0.72 -0.05 0.00 0.02 0.00 0.00 57.07 58.34 1xi9 s TYR 66 Cb -0.10 -3.81 0.10 0.00 -1.52 0.00 0.00 41.96 36.63 1xi9 s TYR 66 CO 0.39 -2.99 1.03 0.20 0.02 0.00 0.00 175.55 174.20 1xi9 s GLY 67 N 1.43 1.75 0.47 0.71 0.00 -1.26 -5.04 107.32 105.37 1xi9 s GLY 67 Ca 0.68 -1.29 -0.24 0.00 0.00 0.00 0.00 44.72 43.86 1xi9 s GLY 67 CO 0.30 -0.79 1.42 -0.35 0.00 0.00 0.00 173.10 173.69 1xi9 s ASP 68 N -4.64 5.71 0.56 1.64 -1.08 -1.26 -4.70 116.67 112.90 1xi9 s ASP 68 Ca 0.64 2.90 0.29 0.00 -0.52 0.00 0.00 52.55 55.86 1xi9 s ASP 68 Cb -0.08 -2.65 1.65 0.00 -1.46 0.00 0.00 42.92 40.38 1xi9 s ASP 68 CO 0.45 -1.28 2.17 0.77 0.52 0.00 0.00 175.17 177.80 1xi9 h SER 69 N 2.11 0.00 1.48 -0.34 4.64 -1.91 0.74 113.55 120.28 1xi9 h SER 69 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 1xi9 h SER 69 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1xi9 h SER 69 CO 0.60 0.06 0.00 -0.33 -0.87 0.00 0.00 176.83 176.29 1xi9 h GLU 70 N 0.00 0.00 0.00 4.77 3.07 -1.88 -3.45 114.58 117.09 1xi9 h GLU 70 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1xi9 h GLU 70 Cb 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 1xi9 h GLU 70 CO 0.01 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.03 1xi9 n GLY 71 N 0.98 1.73 3.74 -3.84 0.00 0.25 -1.20 105.19 106.86 1xi9 n GLY 71 Ca 0.04 -2.01 -0.41 0.00 0.00 0.00 0.00 46.02 43.64 1xi9 n GLY 71 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xi9 s LEU 72 N 0.00 4.42 0.26 0.99 1.02 -1.26 -4.56 118.68 119.54 1xi9 s LEU 72 Ca 0.00 2.49 -0.02 0.00 0.02 0.00 0.00 54.13 56.62 1xi9 s LEU 72 Cb 0.00 -3.62 0.51 0.00 0.02 0.00 0.00 46.19 43.10 1xi9 s LEU 72 CO 0.00 -0.55 1.77 -0.65 0.02 0.00 0.00 176.35 176.94 1xi9 h PRO 73 N 4.95 0.61 -0.56 1.29 0.11 -1.97 -1.07 132.00 135.36 1xi9 h PRO 73 Ca -0.46 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.56 1xi9 h PRO 73 Cb 1.22 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 1xi9 h PRO 73 CO 0.75 0.41 0.12 0.93 -0.21 0.00 0.00 178.00 180.00 1xi9 h GLU 74 N 0.63 0.91 -0.63 1.05 3.07 -1.99 -0.06 114.58 117.56 1xi9 h GLU 74 Ca 0.45 -0.23 -0.04 0.00 -0.50 0.00 0.00 59.36 59.05 1xi9 h GLU 74 Cb 0.62 -0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 28.38 1xi9 h GLU 74 CO -0.35 0.86 0.24 1.25 -1.40 0.00 0.00 179.01 179.60 1xi9 h LEU 75 N 0.81 0.88 -0.91 1.33 5.85 -1.66 -0.88 115.31 120.73 1xi9 h LEU 75 Ca 0.17 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1xi9 h LEU 75 Cb 0.36 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 1xi9 h LEU 75 CO 0.00 0.82 0.52 0.03 -0.34 0.00 0.00 178.44 179.47 1xi9 h ARG 76 N 0.88 1.26 -0.52 1.25 3.08 -0.84 0.12 114.38 119.61 1xi9 h ARG 76 Ca 0.21 -0.14 0.02 0.00 0.07 0.00 0.00 59.98 60.14 1xi9 h ARG 76 Cb 0.23 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 29.99 1xi9 h ARG 76 CO -0.01 0.91 0.32 0.87 -1.07 0.00 0.00 179.97 180.98 1xi9 h LYS 77 N 1.27 0.62 -0.61 0.04 6.56 -0.78 -2.28 116.57 121.39 1xi9 h LYS 77 Ca 0.32 -0.04 -0.03 0.00 -1.06 0.00 0.00 60.65 59.84 1xi9 h LYS 77 Cb 0.00 -0.14 -0.03 0.00 -0.57 0.00 0.00 32.23 31.49 1xi9 h LYS 77 CO -0.05 0.41 0.25 0.00 -2.06 0.00 0.00 179.45 177.99 1xi9 h ALA 78 N 1.23 1.29 -0.42 3.86 0.00 -0.46 -2.65 119.26 122.11 1xi9 h ALA 78 Ca 0.21 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1xi9 h ALA 78 Cb 0.01 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1xi9 h ALA 78 CO -0.09 0.53 -0.06 0.82 0.00 0.00 0.00 179.25 180.45 1xi9 h ILE 79 N 0.87 1.27 -0.19 0.00 2.04 -0.78 -2.31 117.51 118.42 1xi9 h ILE 79 Ca 0.21 -1.13 0.05 0.00 1.00 0.00 0.00 64.86 64.99 1xi9 h ILE 79 Cb 0.16 1.16 -0.06 0.00 -0.74 0.00 0.00 36.82 37.34 1xi9 h ILE 79 CO -0.02 0.38 -0.18 0.58 0.00 0.00 0.00 178.15 178.91 1xi9 h VAL 80 N 0.60 0.52 -0.38 1.67 2.07 -1.15 0.04 116.25 119.61 1xi9 h VAL 80 Ca 0.11 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.58 1xi9 h VAL 80 Cb 0.57 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1xi9 h VAL 80 CO 0.03 0.00 0.03 -0.33 0.02 0.00 0.00 177.57 177.32 1xi9 h GLU 81 N -0.20 0.65 -0.43 1.57 3.07 -1.41 0.15 114.58 117.98 1xi9 h GLU 81 Ca 0.12 -0.19 0.01 0.00 -0.50 0.00 0.00 59.36 58.79 1xi9 h GLU 81 Cb 0.38 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.20 1xi9 h GLU 81 CO -0.31 0.73 0.28 -0.09 -1.40 0.00 0.00 179.01 178.23 1xi9 h ARG 82 N 0.48 0.56 -0.09 2.33 1.12 -1.23 -0.58 114.38 116.97 1xi9 h ARG 82 Ca 0.11 -0.03 -0.14 0.00 -1.11 0.00 0.00 59.98 58.80 1xi9 h ARG 82 Cb 0.42 -0.13 -0.01 0.00 -0.01 0.00 0.00 29.97 30.24 1xi9 h ARG 82 CO 0.01 0.37 -0.58 0.93 -3.11 0.00 0.00 179.97 177.60 1xi9 h GLU 83 N 0.58 0.29 -0.05 0.20 4.39 -0.74 -1.14 114.58 118.10 1xi9 h GLU 83 Ca 0.16 -0.19 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 1xi9 h GLU 83 Cb -0.06 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.61 1xi9 h GLU 83 CO -0.04 0.78 0.01 0.87 -1.16 0.00 0.00 179.01 179.47 1xi9 h LYS 84 N 0.22 0.09 -0.14 2.33 1.57 -0.58 0.14 116.57 120.19 1xi9 h LYS 84 Ca -0.00 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1xi9 h LYS 84 Cb 1.08 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.36 1xi9 h LYS 84 CO 0.09 0.32 0.00 0.00 -0.57 0.00 0.00 179.45 179.29 1xi9 h ARG 85 N -0.15 0.05 -0.02 3.15 3.08 -1.05 -0.34 114.38 119.11 1xi9 h ARG 85 Ca 0.02 -0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.01 1xi9 h ARG 85 Cb 0.27 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1xi9 h ARG 85 CO 0.00 0.03 -0.20 -0.22 -1.07 0.00 0.00 179.97 178.52 1xi9 h LYS 86 N 0.05 0.17 -0.00 0.04 3.64 -1.22 -3.39 116.57 115.86 1xi9 h LYS 86 Ca 0.06 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1xi9 h LYS 86 Cb 0.07 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1xi9 h LYS 86 CO -0.11 0.85 -0.31 0.09 -2.27 0.00 0.00 179.45 177.70 1xi9 n ASN 87 N -4.56 0.81 -0.86 4.20 3.02 0.46 -5.00 115.26 113.34 1xi9 n ASN 87 Ca -0.09 -0.91 -0.11 0.00 -0.03 0.00 0.00 54.58 53.44 1xi9 n ASN 87 Cb 0.45 0.73 -0.05 0.00 -0.61 0.00 0.00 39.78 40.31 1xi9 n ASN 87 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xi9 n GLY 88 N 1.04 1.10 3.76 7.41 0.00 -0.14 -4.50 105.19 113.88 1xi9 n GLY 88 Ca 0.03 -0.06 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 1xi9 n GLY 88 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xi9 s VAL 89 N -2.04 3.22 -0.97 1.61 -7.23 -1.25 -4.97 120.40 108.77 1xi9 s VAL 89 Ca 0.00 1.23 -0.16 0.00 -1.81 0.00 0.00 61.98 61.24 1xi9 s VAL 89 Cb 0.00 -3.78 0.17 0.00 0.56 0.00 0.00 36.38 33.33 1xi9 s VAL 89 CO 0.00 0.29 1.10 -0.62 -0.31 0.00 0.00 175.10 175.56 1xi9 s ASP 90 N -0.72 6.79 0.25 4.85 2.15 -1.26 -4.44 116.67 124.29 1xi9 s ASP 90 Ca 0.46 -2.47 0.11 0.00 0.43 0.00 0.00 52.55 51.08 1xi9 s ASP 90 Cb -0.35 -2.34 -0.05 0.00 -0.30 0.00 0.00 42.92 39.88 1xi9 s ASP 90 CO 0.45 -0.84 -0.19 0.27 -0.17 0.00 0.00 175.17 174.69 1xi9 s ILE 91 N 1.64 2.22 0.34 4.11 -4.36 -1.26 -5.00 121.20 118.89 1xi9 s ILE 91 Ca 0.31 -2.29 0.09 0.00 -0.26 0.00 0.00 60.65 58.49 1xi9 s ILE 91 Cb -0.06 -2.19 -0.06 0.00 1.25 0.00 0.00 42.46 41.41 1xi9 s ILE 91 CO -0.08 -0.43 -0.00 0.42 0.24 0.00 0.00 174.94 175.09 1xi9 s THR 92 N -2.54 2.56 0.56 8.37 -4.23 -1.26 -4.99 115.64 114.10 1xi9 s THR 92 Ca 0.26 -2.01 0.32 0.00 -1.18 0.00 0.00 61.69 59.09 1xi9 s THR 92 Cb -0.04 -2.78 0.48 0.00 1.34 0.00 0.00 72.50 71.50 1xi9 s THR 92 CO 0.12 -0.20 1.84 -0.65 -0.54 0.00 0.00 174.62 175.19 1xi9 h PRO 93 N 1.84 0.00 0.00 3.99 0.11 -1.95 0.28 132.00 136.27 1xi9 h PRO 93 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1xi9 h PRO 93 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1xi9 h PRO 93 CO 0.67 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.21 1xi9 n ASP 94 N -4.05 0.00 -0.80 -2.05 10.43 -1.26 -2.40 116.55 116.42 1xi9 n ASP 94 Ca 0.18 0.02 0.13 0.00 2.57 0.00 0.00 54.79 57.69 1xi9 n ASP 94 Cb 1.01 -0.30 0.25 0.00 1.84 0.00 0.00 41.12 43.92 1xi9 n ASP 94 CO 0.00 0.00 0.00 0.47 -1.07 0.00 0.00 177.20 176.60 1xi9 n ASP 95 N -1.30 2.50 -4.34 -2.24 10.43 0.09 -4.93 116.55 116.76 1xi9 n ASP 95 Ca 0.10 -1.83 -0.32 0.00 2.57 0.00 0.00 54.79 55.31 1xi9 n ASP 95 Cb 0.17 -0.01 -0.15 0.00 1.84 0.00 0.00 41.12 42.96 1xi9 n ASP 95 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1xi9 s VAL 96 N -1.98 2.33 -0.07 2.53 1.01 -1.01 -1.71 120.40 121.51 1xi9 s VAL 96 Ca 0.32 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 61.32 1xi9 s VAL 96 Cb 0.20 -1.85 0.02 0.00 0.00 0.00 0.00 36.38 34.75 1xi9 s VAL 96 CO 0.31 0.58 -0.09 -0.13 0.00 0.00 0.00 175.10 175.77 1xi9 s ARG 97 N -0.46 1.44 0.13 2.72 1.81 -0.06 -4.95 118.95 119.59 1xi9 s ARG 97 Ca 0.05 -0.30 -0.26 0.00 -1.72 0.00 0.00 55.73 53.50 1xi9 s ARG 97 Cb -0.12 -1.31 -0.07 0.00 -0.45 0.00 0.00 34.95 33.01 1xi9 s ARG 97 CO 0.01 -0.07 0.82 0.08 -0.68 0.00 0.00 175.30 175.46 1xi9 s VAL 98 N 0.98 4.45 0.27 3.52 1.01 -0.34 -0.91 120.40 129.39 1xi9 s VAL 98 Ca -0.09 1.79 0.05 0.00 0.00 0.00 0.00 61.98 63.72 1xi9 s VAL 98 Cb -0.15 -4.18 -0.06 0.00 0.00 0.00 0.00 36.38 31.99 1xi9 s VAL 98 CO 0.00 0.45 -0.00 0.42 0.00 0.00 0.00 175.10 175.96 1xi9 s THR 99 N -0.68 1.26 -1.41 3.92 -4.23 -0.30 -4.56 115.64 109.64 1xi9 s THR 99 Ca 0.39 -2.05 -0.15 0.00 -1.18 0.00 0.00 61.69 58.69 1xi9 s THR 99 Cb -0.23 -2.50 0.04 0.00 1.34 0.00 0.00 72.50 71.15 1xi9 s THR 99 CO 0.27 -0.23 2.11 0.00 -0.54 0.00 0.00 174.62 176.23 1xi9 n ALA 100 N -0.54 5.02 -0.34 3.99 0.00 -1.26 -1.56 120.51 125.81 1xi9 n ALA 100 Ca -0.04 -3.86 0.05 0.00 0.00 0.00 0.00 53.44 49.59 1xi9 n ALA 100 Cb 0.64 -3.56 -0.01 0.00 0.00 0.00 0.00 19.45 16.52 1xi9 n ALA 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xi9 n ALA 101 N 6.71 -0.89 0.13 0.00 0.00 -1.10 -2.97 120.51 122.39 1xi9 n ALA 101 Ca 0.51 0.12 0.03 0.00 0.00 0.00 0.00 53.44 54.11 1xi9 n ALA 101 Cb 0.41 -0.32 0.41 0.00 0.00 0.00 0.00 19.45 19.95 1xi9 n ALA 101 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1xi9 h VAL 102 N -0.32 1.17 -0.47 0.00 2.07 -1.84 -2.68 116.25 114.18 1xi9 h VAL 102 Ca -0.00 -0.74 0.10 0.00 0.82 0.00 0.00 66.70 66.88 1xi9 h VAL 102 Cb 0.32 1.21 -0.09 0.00 -1.52 0.00 0.00 31.29 31.21 1xi9 h VAL 102 CO 0.00 0.23 -0.18 0.74 0.02 0.00 0.00 177.57 178.39 1xi9 h THR 103 N 0.20 0.42 -0.07 2.57 2.02 -1.98 -0.52 112.91 115.55 1xi9 h THR 103 Ca 0.04 0.00 -0.16 0.00 0.77 0.00 0.00 66.41 67.06 1xi9 h THR 103 Cb 0.35 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 1xi9 h THR 103 CO 0.02 0.00 -0.64 -0.08 0.37 0.00 0.00 175.52 175.19 1xi9 h GLU 104 N -0.07 0.27 -0.25 6.66 4.81 -1.38 -2.14 114.58 122.48 1xi9 h GLU 104 Ca 0.23 -0.20 0.06 0.00 -0.13 0.00 0.00 59.36 59.32 1xi9 h GLU 104 Cb 0.42 0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.76 1xi9 h GLU 104 CO -0.52 0.82 -0.25 0.00 -0.73 0.00 0.00 179.01 178.34 1xi9 h ALA 105 N 1.13 -0.13 -0.85 2.92 0.00 -1.08 -0.73 119.26 120.53 1xi9 h ALA 105 Ca -0.01 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1xi9 h ALA 105 Cb 1.17 0.51 -0.04 0.00 0.00 0.00 0.00 17.79 19.43 1xi9 h ALA 105 CO 0.10 -0.67 0.54 -0.07 0.00 0.00 0.00 179.25 179.15 1xi9 h LEU 106 N -0.25 0.99 -0.18 0.00 3.38 -0.89 -0.08 115.31 118.28 1xi9 h LEU 106 Ca 0.14 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1xi9 h LEU 106 Cb 0.46 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1xi9 h LEU 106 CO -0.39 0.74 0.12 1.56 0.09 0.00 0.00 178.44 180.55 1xi9 h GLN 107 N 1.15 0.24 -0.30 1.13 4.20 -0.98 0.28 115.11 120.83 1xi9 h GLN 107 Ca 0.31 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.97 1xi9 h GLN 107 Cb -0.10 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.62 1xi9 h GLN 107 CO -0.06 0.17 0.08 -0.07 -0.67 0.00 0.00 178.83 178.27 1xi9 h LEU 108 N 0.24 0.45 0.21 1.46 3.38 -0.88 -0.23 115.31 119.94 1xi9 h LEU 108 Ca 0.07 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 1xi9 h LEU 108 Cb -0.02 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.62 1xi9 h LEU 108 CO -0.01 0.56 -0.10 0.40 0.09 0.00 0.00 178.44 179.37 1xi9 h ILE 109 N 0.32 0.87 -0.70 1.22 2.04 -0.86 -1.21 117.51 119.19 1xi9 h ILE 109 Ca 0.09 -0.46 -0.05 0.00 1.00 0.00 0.00 64.86 65.44 1xi9 h ILE 109 Cb 0.28 1.14 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 1xi9 h ILE 109 CO -0.00 0.10 0.23 -0.26 0.00 0.00 0.00 178.15 178.23 1xi9 h PHE 110 N -0.51 1.11 -0.90 1.37 0.05 -1.01 -0.39 116.94 116.66 1xi9 h PHE 110 Ca -0.03 -0.11 0.11 0.00 3.82 0.00 0.00 57.97 61.76 1xi9 h PHE 110 Cb 0.38 -0.32 -0.08 0.00 2.00 0.00 0.00 35.95 37.93 1xi9 h PHE 110 CO 0.00 0.88 0.54 0.78 -0.18 0.00 0.00 178.31 180.33 1xi9 h GLY 111 N 1.02 1.43 1.88 -1.45 0.00 -0.99 -1.41 103.07 103.55 1xi9 h GLY 111 Ca 0.23 -0.36 -0.19 0.00 0.00 0.00 0.00 47.33 47.01 1xi9 h GLY 111 CO -0.01 0.14 -0.96 0.00 0.00 0.00 0.00 176.54 175.71 1xi9 h ALA 112 N 1.49 0.47 0.05 3.60 0.00 -0.91 -3.36 119.26 120.61 1xi9 h ALA 112 Ca 0.44 -0.85 -0.30 0.00 0.00 0.00 0.00 54.91 54.20 1xi9 h ALA 112 Cb 0.42 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1xi9 h ALA 112 CO -0.26 1.12 -1.64 -0.07 0.00 0.00 0.00 179.25 178.40 1xi9 h LEU 113 N 0.00 0.17 -9.14 0.00 3.38 -0.89 -3.47 115.31 105.36 1xi9 h LEU 113 Ca -0.04 -0.31 -0.61 0.00 0.09 0.00 0.00 57.88 57.02 1xi9 h LEU 113 Cb 1.69 -0.06 -0.13 0.00 0.09 0.00 0.00 40.66 42.26 1xi9 h LEU 113 CO 0.11 1.27 -0.36 -0.76 0.09 0.00 0.00 178.44 178.78 1xi9 s LEU 114 N -6.55 4.15 0.25 1.67 1.43 -0.55 -5.04 118.68 114.05 1xi9 s LEU 114 Ca -0.08 0.32 0.06 0.00 -1.03 0.00 0.00 54.13 53.40 1xi9 s LEU 114 Cb 0.08 -2.30 -0.03 0.00 0.03 0.00 0.00 46.19 43.97 1xi9 s LEU 114 CO 0.82 0.02 0.31 -1.81 0.23 0.00 0.00 176.35 175.91 1xi9 s ASP 115 N 0.95 5.98 0.14 2.29 -0.00 -1.26 -4.92 116.67 119.85 1xi9 s ASP 115 Ca 0.13 -0.08 -0.35 0.00 -0.00 0.00 0.00 52.55 52.25 1xi9 s ASP 115 Cb -0.14 -1.63 -0.15 0.00 -0.00 0.00 0.00 42.92 41.00 1xi9 s ASP 115 CO 0.05 -0.09 1.47 -2.65 -0.00 0.00 0.00 175.17 173.95 1xi9 n PRO 116 N -1.34 1.75 -0.98 8.23 -0.02 -1.26 -1.82 135.00 139.56 1xi9 n PRO 116 Ca -0.08 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1xi9 n PRO 116 Cb 0.57 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 1xi9 n PRO 116 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xi9 n GLY 117 N 2.96 0.93 3.79 -1.23 0.00 -0.21 -4.99 105.19 106.43 1xi9 n GLY 117 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 1xi9 n GLY 117 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xi9 s ASP 118 N -2.90 5.86 0.16 1.61 -0.00 -0.75 -4.65 116.67 116.00 1xi9 s ASP 118 Ca 0.00 2.00 0.09 0.00 -0.00 0.00 0.00 52.55 54.64 1xi9 s ASP 118 Cb 0.00 -2.56 -0.04 0.00 -0.00 0.00 0.00 42.92 40.32 1xi9 s ASP 118 CO 0.00 -1.12 -0.15 -1.61 -0.00 0.00 0.00 175.17 172.29 1xi9 s GLU 119 N -3.54 1.88 -0.06 8.23 2.02 0.77 -0.61 118.70 127.39 1xi9 s GLU 119 Ca 0.68 -1.28 0.02 0.00 0.02 0.00 0.00 54.97 54.41 1xi9 s GLU 119 Cb -0.19 -2.09 0.02 0.00 0.10 0.00 0.00 34.13 31.96 1xi9 s GLU 119 CO 0.29 0.45 -0.09 0.42 0.02 0.00 0.00 175.26 176.34 1xi9 s ILE 120 N -1.50 0.91 -0.06 -1.63 -1.09 -1.07 0.01 121.20 116.78 1xi9 s ILE 120 Ca 0.22 -0.35 -0.30 0.00 -2.23 0.00 0.00 60.65 57.99 1xi9 s ILE 120 Cb -0.09 -0.86 -0.02 0.00 -1.58 0.00 0.00 42.46 39.90 1xi9 s ILE 120 CO 0.13 0.31 1.06 -0.76 -1.23 0.00 0.00 174.94 174.44 1xi9 s LEU 121 N 0.75 4.29 0.11 2.97 1.43 -0.34 -0.94 118.68 126.95 1xi9 s LEU 121 Ca -0.13 1.65 0.07 0.00 -1.03 0.00 0.00 54.13 54.69 1xi9 s LEU 121 Cb -0.15 -3.56 -0.04 0.00 0.03 0.00 0.00 46.19 42.47 1xi9 s LEU 121 CO 0.02 -0.44 -0.18 0.68 0.23 0.00 0.00 176.35 176.67 1xi9 s VAL 122 N 1.78 1.56 0.69 -1.59 -7.23 0.05 -0.17 120.40 115.48 1xi9 s VAL 122 Ca 0.51 -1.61 -0.14 0.00 -1.81 0.00 0.00 61.98 58.93 1xi9 s VAL 122 Cb -0.21 -1.53 0.02 0.00 0.56 0.00 0.00 36.38 35.22 1xi9 s VAL 122 CO 0.22 -0.21 1.10 -2.16 -0.31 0.00 0.00 175.10 173.74 1xi9 s PRO 123 N -2.21 2.65 -0.09 4.82 0.04 -1.26 -0.70 135.00 138.25 1xi9 s PRO 123 Ca 0.07 1.31 0.00 0.00 0.04 0.00 0.00 61.00 62.42 1xi9 s PRO 123 Cb -0.08 -1.94 0.02 0.00 0.04 0.00 0.00 34.50 32.54 1xi9 s PRO 123 CO 0.04 -1.35 -0.07 0.20 0.04 0.00 0.00 177.00 175.86 1xi9 s GLY 124 N -2.86 0.72 0.46 0.56 0.00 0.36 -3.28 107.32 103.28 1xi9 s GLY 124 Ca 0.65 -0.39 -0.24 0.00 0.00 0.00 0.00 44.72 44.73 1xi9 s GLY 124 CO 0.46 0.65 1.33 -1.05 0.00 0.00 0.00 173.10 174.49 1xi9 n PRO 125 N 4.60 1.96 -4.14 2.90 -0.02 -1.26 -2.02 135.00 137.02 1xi9 n PRO 125 Ca -0.16 0.70 -0.27 0.00 -2.02 0.00 0.00 63.50 61.76 1xi9 n PRO 125 Cb 0.50 -2.50 -0.07 0.00 -0.02 0.00 0.00 33.50 31.42 1xi9 n PRO 125 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1xi9 s SER 126 N -0.61 5.16 -0.37 2.55 1.04 -0.12 -4.66 113.70 116.70 1xi9 s SER 126 Ca 0.64 -0.24 -0.19 0.00 0.48 0.00 0.00 55.95 56.63 1xi9 s SER 126 Cb -0.47 -1.24 0.00 0.00 0.10 0.00 0.00 66.02 64.41 1xi9 s SER 126 CO 0.56 0.09 0.57 -0.47 0.98 0.00 0.00 173.24 174.96 1xi9 s TYR 127 N -1.70 3.15 0.31 5.02 6.14 -1.26 -4.60 117.35 124.42 1xi9 s TYR 127 Ca 0.29 0.17 0.03 0.00 0.64 0.00 0.00 57.07 58.20 1xi9 s TYR 127 Cb -0.10 -3.05 0.62 0.00 0.42 0.00 0.00 41.96 39.85 1xi9 s TYR 127 CO 0.21 -0.62 1.87 -1.35 0.64 0.00 0.00 175.55 176.30 1xi9 h PRO 128 N 8.53 0.89 -0.70 4.97 0.11 -1.94 -2.07 132.00 141.80 1xi9 h PRO 128 Ca -0.27 -0.05 0.19 0.00 0.11 0.00 0.00 66.00 65.98 1xi9 h PRO 128 Cb 1.12 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 31.99 1xi9 h PRO 128 CO 0.81 0.59 0.49 -1.35 -0.21 0.00 0.00 178.00 178.34 1xi9 h PRO 129 N 0.92 0.09 -0.43 1.05 0.11 -1.95 -1.77 132.00 130.02 1xi9 h PRO 129 Ca 0.44 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.49 1xi9 h PRO 129 Cb 0.44 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.51 1xi9 h PRO 129 CO -0.20 0.06 0.07 1.88 -0.21 0.00 0.00 178.00 179.59 1xi9 h TYR 130 N 0.09 0.76 -0.26 0.65 -1.99 -1.80 -1.35 116.97 113.08 1xi9 h TYR 130 Ca 0.34 -0.11 -0.01 0.00 2.00 0.00 0.00 58.73 60.95 1xi9 h TYR 130 Cb 1.21 -0.21 -0.01 0.00 2.00 0.00 0.00 36.73 39.72 1xi9 h TYR 130 CO -0.00 0.73 0.14 1.15 -0.00 0.00 0.00 178.16 180.18 1xi9 h THR 131 N 0.57 1.12 -0.28 -2.88 2.02 -1.45 -1.35 112.91 110.67 1xi9 h THR 131 Ca 0.13 -0.33 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 1xi9 h THR 131 Cb 0.38 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 1xi9 h THR 131 CO 0.01 0.12 0.10 1.23 0.37 0.00 0.00 175.52 177.35 1xi9 h GLY 132 N 0.30 0.46 1.05 2.16 0.00 -1.38 -2.69 103.07 102.97 1xi9 h GLY 132 Ca 0.09 -0.26 -0.06 0.00 0.00 0.00 0.00 47.33 47.10 1xi9 h GLY 132 CO -0.01 0.24 0.22 1.41 0.00 0.00 0.00 176.54 178.40 1xi9 h LEU 133 N 0.29 1.05 -0.22 3.11 3.38 -1.14 -0.25 115.31 121.53 1xi9 h LEU 133 Ca 0.09 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 1xi9 h LEU 133 Cb 0.22 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1xi9 h LEU 133 CO -0.00 0.98 -0.02 0.58 0.09 0.00 0.00 178.44 180.06 1xi9 h VAL 134 N 1.07 1.27 -0.84 1.22 2.07 -1.26 -2.15 116.25 117.63 1xi9 h VAL 134 Ca 0.23 -0.96 0.05 0.00 0.82 0.00 0.00 66.70 66.84 1xi9 h VAL 134 Cb 0.31 1.46 -0.06 0.00 -1.52 0.00 0.00 31.29 31.49 1xi9 h VAL 134 CO -0.01 0.29 0.52 0.11 0.02 0.00 0.00 177.57 178.51 1xi9 h LYS 135 N 0.15 0.95 -0.64 1.57 1.57 -1.36 0.63 116.57 119.43 1xi9 h LYS 135 Ca 0.06 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 1xi9 h LYS 135 Cb 0.45 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.52 1xi9 h LYS 135 CO 0.02 0.63 0.13 0.35 -0.57 0.00 0.00 179.45 180.01 1xi9 h PHE 136 N 0.98 1.10 0.00 -1.35 3.57 -0.89 -2.32 116.94 118.03 1xi9 h PHE 136 Ca 0.35 -0.14 0.00 0.00 3.53 0.00 0.00 57.97 61.71 1xi9 h PHE 136 Cb 0.11 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.54 1xi9 h PHE 136 CO -0.03 0.92 0.00 0.66 -2.23 0.00 0.00 178.31 177.63 1xi9 n TYR 137 N -4.29 0.00 -0.72 0.41 4.02 -0.82 -4.85 117.16 110.91 1xi9 n TYR 137 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.93 1xi9 n TYR 137 Cb 0.26 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.56 1xi9 n TYR 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1xi9 n GLY 138 N 0.33 0.78 3.97 2.72 0.00 -0.87 -4.62 105.19 107.50 1xi9 n GLY 138 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1xi9 n GLY 138 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xi9 s GLY 139 N -1.83 1.77 -0.25 -0.02 0.00 0.18 -1.05 107.32 106.12 1xi9 s GLY 139 Ca 0.00 -1.38 -0.01 0.00 0.00 0.00 0.00 44.72 43.33 1xi9 s GLY 139 CO 0.00 -0.94 -0.06 1.25 0.00 0.00 0.00 173.10 173.35 1xi9 s LYS 140 N -5.07 2.71 0.02 2.90 2.20 0.22 -3.85 119.74 118.87 1xi9 s LYS 140 Ca 0.62 -1.06 -0.30 0.00 -0.36 0.00 0.00 55.97 54.88 1xi9 s LYS 140 Cb -0.08 -2.99 -0.04 0.00 -1.51 0.00 0.00 37.83 33.22 1xi9 s LYS 140 CO 0.43 -0.44 0.97 -1.25 -0.36 0.00 0.00 175.35 174.69 1xi9 s PRO 141 N 1.29 4.58 -0.21 4.03 0.04 -1.26 -2.58 135.00 140.89 1xi9 s PRO 141 Ca -0.01 1.40 0.01 0.00 0.04 0.00 0.00 61.00 62.44 1xi9 s PRO 141 Cb -0.17 -3.44 0.04 0.00 0.04 0.00 0.00 34.50 30.96 1xi9 s PRO 141 CO -0.04 0.00 -0.14 0.08 0.04 0.00 0.00 177.00 176.94 1xi9 s VAL 142 N 0.82 1.91 -0.07 -0.36 1.01 -0.11 -4.96 120.40 118.64 1xi9 s VAL 142 Ca 0.51 -1.14 -0.28 0.00 0.00 0.00 0.00 61.98 61.07 1xi9 s VAL 142 Cb -0.21 -1.90 -0.02 0.00 0.00 0.00 0.00 36.38 34.24 1xi9 s VAL 142 CO 0.28 0.24 0.92 -1.61 0.00 0.00 0.00 175.10 174.93 1xi9 s GLU 143 N 1.29 4.46 0.02 2.72 2.02 -1.25 -0.77 118.70 127.18 1xi9 s GLU 143 Ca -0.01 1.26 -0.01 0.00 0.02 0.00 0.00 54.97 56.23 1xi9 s GLU 143 Cb -0.16 -3.50 -0.04 0.00 0.10 0.00 0.00 34.13 30.53 1xi9 s GLU 143 CO -0.09 -0.15 0.15 1.52 0.02 0.00 0.00 175.26 176.72 1xi9 s TYR 144 N 1.43 3.45 0.28 1.61 -0.85 0.12 -4.87 117.35 118.52 1xi9 s TYR 144 Ca 0.46 0.27 -0.29 0.00 -0.52 0.00 0.00 57.07 56.99 1xi9 s TYR 144 Cb -0.19 -1.77 -0.10 0.00 0.38 0.00 0.00 41.96 40.28 1xi9 s TYR 144 CO 0.21 0.60 1.20 0.50 -1.52 0.00 0.00 175.55 176.54 1xi9 s ARG 145 N -2.07 4.50 0.14 -3.49 3.52 -1.26 -0.49 118.95 119.80 1xi9 s ARG 145 Ca 0.28 1.98 0.09 0.00 -0.13 0.00 0.00 55.73 57.95 1xi9 s ARG 145 Cb -0.13 -3.15 -0.04 0.00 -1.56 0.00 0.00 34.95 30.07 1xi9 s ARG 145 CO 0.20 -0.00 -0.18 0.95 -0.81 0.00 0.00 175.30 175.46 1xi9 s THR 146 N -0.91 2.80 -0.31 4.11 -4.23 -0.86 -0.23 115.64 116.02 1xi9 s THR 146 Ca 0.48 -1.60 -0.07 0.00 -1.18 0.00 0.00 61.69 59.32 1xi9 s THR 146 Cb -0.35 -2.31 0.02 0.00 1.34 0.00 0.00 72.50 71.20 1xi9 s THR 146 CO 0.44 0.04 0.09 -0.63 -0.54 0.00 0.00 174.62 174.03 1xi9 s ILE 147 N -1.28 3.92 0.20 2.99 1.01 0.38 -4.81 121.20 123.60 1xi9 s ILE 147 Ca 0.19 -0.86 -0.11 0.00 0.00 0.00 0.00 60.65 59.87 1xi9 s ILE 147 Cb -0.10 -3.10 0.13 0.00 0.01 0.00 0.00 42.46 39.40 1xi9 s ILE 147 CO 0.11 -0.02 1.73 -0.08 0.00 0.00 0.00 174.94 176.67 1xi9 h GLU 148 N 8.24 0.32 -0.00 2.79 4.81 -1.93 0.44 114.58 129.24 1xi9 h GLU 148 Ca -0.28 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1xi9 h GLU 148 Cb 1.11 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.42 1xi9 h GLU 148 CO 0.61 0.21 0.04 1.05 -0.73 0.00 0.00 179.01 180.19 1xi9 h GLU 149 N 0.33 0.00 -0.43 1.92 4.11 -1.98 -0.83 114.58 117.69 1xi9 h GLU 149 Ca 0.28 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.67 1xi9 h GLU 149 Cb 0.36 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1xi9 h GLU 149 CO -0.31 0.00 0.03 0.39 0.07 0.00 0.00 179.01 179.19 1xi9 n GLU 150 N -3.12 3.63 -3.46 1.06 1.02 -0.67 -4.92 120.64 114.18 1xi9 n GLU 150 Ca -0.03 -3.01 -0.20 0.00 -0.02 0.00 0.00 57.16 53.90 1xi9 n GLU 150 Cb 0.11 -2.04 0.08 0.00 -0.02 0.00 0.00 31.44 29.57 1xi9 n GLU 150 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1xi9 n ASP 151 N -0.13 -4.77 -2.76 1.62 10.43 -0.32 -3.56 116.55 117.07 1xi9 n ASP 151 Ca 0.27 -0.53 -0.19 0.00 2.57 0.00 0.00 54.79 56.91 1xi9 n ASP 151 Cb 1.07 -4.77 0.05 0.00 1.84 0.00 0.00 41.12 39.31 1xi9 n ASP 151 CO 0.00 0.00 0.00 0.79 -1.07 0.00 0.00 177.20 176.92 1xi9 n TRP 152 N -4.55 -2.01 -2.69 1.24 7.02 0.14 -4.45 117.44 112.14 1xi9 n TRP 152 Ca -0.08 0.65 -0.37 0.00 -1.02 0.00 0.00 57.50 56.68 1xi9 n TRP 152 Cb 0.59 -4.05 -0.06 0.00 -2.42 0.00 0.00 31.31 25.37 1xi9 n TRP 152 CO 0.00 0.00 0.00 -0.65 -2.02 0.00 0.00 177.69 175.02 1xi9 s GLN 153 N -5.81 4.42 0.32 -0.99 -1.52 -1.22 -4.49 119.66 110.36 1xi9 s GLN 153 Ca 0.38 1.39 -0.27 0.00 -1.95 0.00 0.00 55.36 54.92 1xi9 s GLN 153 Cb -0.17 -2.68 -0.14 0.00 -0.22 0.00 0.00 33.01 29.80 1xi9 s GLN 153 CO 0.47 0.11 0.88 -2.30 -0.25 0.00 0.00 175.29 174.20 1xi9 n PRO 154 N 0.28 1.07 -3.13 2.91 -0.02 -1.26 -0.47 135.00 134.38 1xi9 n PRO 154 Ca 0.03 0.38 -0.45 0.00 -2.02 0.00 0.00 63.50 61.44 1xi9 n PRO 154 Cb 0.50 -1.72 -0.05 0.00 -0.02 0.00 0.00 33.50 32.22 1xi9 n PRO 154 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1xi9 s ASP 155 N -0.70 6.19 0.42 2.55 3.68 0.69 -4.80 116.67 124.69 1xi9 s ASP 155 Ca 0.60 -1.40 0.11 0.00 2.13 0.00 0.00 52.55 53.99 1xi9 s ASP 155 Cb -0.69 -2.29 0.90 0.00 -1.45 0.00 0.00 42.92 39.38 1xi9 s ASP 155 CO 0.59 -1.07 1.99 0.40 0.13 0.00 0.00 175.17 177.21 1xi9 h ILE 156 N 5.91 1.13 -0.10 4.11 5.03 -1.93 -0.28 117.51 131.39 1xi9 h ILE 156 Ca -0.29 -0.53 -0.13 0.00 -0.12 0.00 0.00 64.86 63.78 1xi9 h ILE 156 Cb 1.09 1.07 -0.01 0.00 -3.03 0.00 0.00 36.82 35.93 1xi9 h ILE 156 CO 1.08 0.17 -0.52 0.44 -0.68 0.00 0.00 178.15 178.64 1xi9 h ASP 157 N 0.22 0.31 -0.24 1.72 3.45 -1.97 -1.25 116.42 118.66 1xi9 h ASP 157 Ca 0.05 -0.16 -0.16 0.00 0.43 0.00 0.00 57.03 57.19 1xi9 h ASP 157 Cb 0.23 -0.09 -0.01 0.00 -0.56 0.00 0.00 39.33 38.91 1xi9 h ASP 157 CO 0.01 0.78 -0.44 -0.78 -1.57 0.00 0.00 179.24 177.24 1xi9 h ASP 158 N 0.22 0.86 -0.06 6.45 3.58 -1.47 -1.28 116.42 124.72 1xi9 h ASP 158 Ca 0.01 -0.41 0.00 0.00 0.42 0.00 0.00 57.03 57.05 1xi9 h ASP 158 Cb 1.00 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 41.80 1xi9 h ASP 158 CO 0.08 1.17 0.03 0.40 -2.88 0.00 0.00 179.24 178.04 1xi9 h ILE 159 N 0.64 1.00 -0.23 2.25 2.04 -1.03 -1.14 117.51 121.03 1xi9 h ILE 159 Ca 0.04 -0.02 0.05 0.00 1.00 0.00 0.00 64.86 65.93 1xi9 h ILE 159 Cb 1.01 0.93 -0.05 0.00 -0.74 0.00 0.00 36.82 37.97 1xi9 h ILE 159 CO 0.10 0.01 -0.10 -0.09 0.00 0.00 0.00 178.15 178.07 1xi9 h ARG 160 N 0.06 -0.06 -0.58 2.37 2.43 -1.14 -2.05 114.38 115.41 1xi9 h ARG 160 Ca 0.02 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.17 1xi9 h ARG 160 Cb 0.00 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.54 1xi9 h ARG 160 CO -0.02 -0.04 0.25 -0.22 -1.51 0.00 0.00 179.97 178.43 1xi9 h LYS 161 N -0.07 0.84 0.00 0.20 1.63 -1.09 -3.17 116.57 114.91 1xi9 h LYS 161 Ca 0.12 -0.12 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1xi9 h LYS 161 Cb 0.25 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 31.73 1xi9 h LYS 161 CO -0.28 0.68 -0.48 0.87 -3.45 0.00 0.00 179.45 176.79 1xi9 h LYS 162 N 0.83 0.00 -6.69 1.90 1.79 -0.90 -3.45 116.57 110.05 1xi9 h LYS 162 Ca 0.20 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 58.11 1xi9 h LYS 162 Cb 0.14 0.00 0.08 0.00 -1.58 0.00 0.00 32.23 30.87 1xi9 h LYS 162 CO -0.02 0.00 0.76 -0.89 -1.08 0.00 0.00 179.45 178.22 1xi9 n ILE 163 N -2.69 0.93 -4.60 1.86 2.08 -0.80 -5.02 119.36 111.12 1xi9 n ILE 163 Ca 0.03 -0.23 -0.29 0.00 0.56 0.00 0.00 62.75 62.82 1xi9 n ILE 163 Cb 0.51 -1.73 -0.08 0.00 -0.75 0.00 0.00 39.64 37.59 1xi9 n ILE 163 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 1xi9 s THR 164 N 0.03 0.72 -1.32 1.39 -4.23 -1.26 -5.03 115.64 105.94 1xi9 s THR 164 Ca 0.67 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.45 1xi9 s THR 164 Cb -0.57 -2.24 0.42 0.00 1.34 0.00 0.00 72.50 71.45 1xi9 s THR 164 CO 0.48 0.00 1.93 -0.90 -0.54 0.00 0.00 174.62 175.59 1xi9 n ASP 165 N -1.37 0.00 -0.30 3.99 5.75 -1.26 -2.52 116.55 120.84 1xi9 n ASP 165 Ca -0.11 0.04 0.14 0.00 -0.01 0.00 0.00 54.79 54.86 1xi9 n ASP 165 Cb 0.65 -0.34 0.65 0.00 -1.03 0.00 0.00 41.12 41.06 1xi9 n ASP 165 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1xi9 n ARG 166 N -1.34 1.42 -2.57 0.11 5.12 -1.26 -4.90 116.66 113.23 1xi9 n ARG 166 Ca 0.11 -0.61 -0.43 0.00 -1.93 0.00 0.00 57.85 55.00 1xi9 n ARG 166 Cb 0.24 -1.47 -0.02 0.00 -1.16 0.00 0.00 32.46 30.05 1xi9 n ARG 166 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1xi9 s THR 167 N -1.98 4.53 -0.19 0.55 2.01 -1.05 -0.16 115.64 119.34 1xi9 s THR 167 Ca 0.40 1.84 0.19 0.00 0.31 0.00 0.00 61.69 64.43 1xi9 s THR 167 Cb 0.21 -4.19 -0.27 0.00 0.01 0.00 0.00 72.50 68.26 1xi9 s THR 167 CO 0.33 -0.13 0.49 0.29 -0.69 0.00 0.00 174.62 174.91 1xi9 n LYS 168 N 6.14 0.65 -3.48 4.92 4.76 0.10 -4.91 118.16 126.35 1xi9 n LYS 168 Ca 0.12 -0.14 -0.10 0.00 -2.87 0.00 0.00 58.31 55.33 1xi9 n LYS 168 Cb 0.46 -1.43 -0.02 0.00 -1.84 0.00 0.00 35.03 32.20 1xi9 n LYS 168 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1xi9 s ALA 169 N -3.19 -1.73 -0.21 7.82 0.00 -1.25 -4.16 121.76 119.04 1xi9 s ALA 169 Ca -0.04 0.80 -0.03 0.00 0.00 0.00 0.00 51.96 52.69 1xi9 s ALA 169 Cb 0.12 0.60 -0.01 0.00 0.00 0.00 0.00 23.12 23.83 1xi9 s ALA 169 CO 0.78 -0.72 -0.06 0.42 0.00 0.00 0.00 175.76 176.17 1xi9 s ILE 170 N -3.36 3.28 -0.04 0.00 1.01 -0.93 -1.20 121.20 119.96 1xi9 s ILE 170 Ca 0.04 -0.53 -0.18 0.00 0.00 0.00 0.00 60.65 59.97 1xi9 s ILE 170 Cb -0.01 -2.47 -0.05 0.00 0.01 0.00 0.00 42.46 39.94 1xi9 s ILE 170 CO -0.10 0.44 0.51 0.00 0.00 0.00 0.00 174.94 175.79 1xi9 s ALA 171 N 1.30 3.54 -0.14 9.38 0.00 0.76 -0.60 121.76 136.00 1xi9 s ALA 171 Ca 0.04 -0.10 0.02 0.00 0.00 0.00 0.00 51.96 51.92 1xi9 s ALA 171 Cb -0.14 -2.62 0.01 0.00 0.00 0.00 0.00 23.12 20.36 1xi9 s ALA 171 CO -0.03 0.20 -0.20 0.08 0.00 0.00 0.00 175.76 175.81 1xi9 s VAL 172 N -0.19 2.21 -0.36 0.00 1.01 0.16 -4.37 120.40 118.86 1xi9 s VAL 172 Ca 0.28 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.35 1xi9 s VAL 172 Cb -0.17 -1.89 0.10 0.00 0.00 0.00 0.00 36.38 34.42 1xi9 s VAL 172 CO 0.14 0.54 0.10 -0.63 0.00 0.00 0.00 175.10 175.25 1xi9 s ILE 173 N 0.78 2.55 -0.16 2.22 1.01 -1.26 0.64 121.20 126.97 1xi9 s ILE 173 Ca -0.07 -2.30 -0.06 0.00 0.00 0.00 0.00 60.65 58.22 1xi9 s ILE 173 Cb -0.16 -2.84 0.08 0.00 0.01 0.00 0.00 42.46 39.55 1xi9 s ILE 173 CO -0.01 -0.63 0.34 0.21 0.00 0.00 0.00 174.94 174.86 1xi9 s ASN 174 N 1.11 0.01 0.83 3.58 2.47 -0.92 -3.30 114.94 118.72 1xi9 s ASN 174 Ca 0.10 0.80 -0.12 0.00 0.42 0.00 0.00 52.86 54.06 1xi9 s ASN 174 Cb -0.20 1.02 0.10 0.00 -1.45 0.00 0.00 41.25 40.71 1xi9 s ASN 174 CO -0.07 -0.23 1.19 -2.84 -3.72 0.00 0.00 177.10 171.43 1xi9 s PRO 175 N 2.46 1.48 -0.00 0.43 0.02 -1.26 -4.36 135.00 133.77 1xi9 s PRO 175 Ca -0.01 1.70 -0.12 0.00 0.02 0.00 0.00 61.00 62.59 1xi9 s PRO 175 Cb -0.12 -1.76 -0.05 0.00 0.02 0.00 0.00 34.50 32.58 1xi9 s PRO 175 CO -0.11 -2.32 0.37 1.21 -0.33 0.00 0.00 177.00 175.82 1xi9 s ASN 176 N -2.30 6.71 -0.14 2.53 3.84 -0.70 -4.71 114.94 120.18 1xi9 s ASN 176 Ca 0.71 0.85 0.02 0.00 0.21 0.00 0.00 52.86 54.65 1xi9 s ASN 176 Cb -0.27 -2.21 0.00 0.00 -0.55 0.00 0.00 41.25 38.22 1xi9 s ASN 176 CO 0.52 0.31 -0.19 0.21 -2.79 0.00 0.00 177.10 175.16 1xi9 s ASN 177 N -1.22 3.42 0.00 -4.21 2.47 -1.26 -1.03 114.94 113.10 1xi9 s ASN 177 Ca 0.24 -0.51 0.24 0.00 0.42 0.00 0.00 52.86 53.25 1xi9 s ASN 177 Cb -0.15 -1.50 0.50 0.00 -1.45 0.00 0.00 41.25 38.64 1xi9 s ASN 177 CO 0.13 0.11 1.43 -0.81 -3.72 0.00 0.00 177.10 174.24 1xi9 n PRO 178 N 3.90 2.17 0.03 0.43 -0.04 -1.26 -4.31 135.00 135.92 1xi9 n PRO 178 Ca -0.19 -1.72 -0.03 0.00 -0.04 0.00 0.00 63.50 61.51 1xi9 n PRO 178 Cb 0.52 -1.47 -0.09 0.00 -0.04 0.00 0.00 33.50 32.42 1xi9 n PRO 178 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1xi9 h THR 179 N 3.85 0.81 0.00 0.52 1.35 -1.89 -3.38 112.91 114.17 1xi9 h THR 179 Ca 0.00 -2.42 0.00 0.00 -0.55 0.00 0.00 66.41 63.44 1xi9 h THR 179 Cb 0.83 2.30 0.00 0.00 -1.73 0.00 0.00 68.15 69.55 1xi9 h THR 179 CO 0.00 0.46 0.00 0.61 -0.25 0.00 0.00 175.52 176.34 1xi9 n GLY 180 N 1.42 0.62 3.68 5.82 0.00 -0.20 -4.50 105.19 112.03 1xi9 n GLY 180 Ca -0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.57 1xi9 n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xi9 n ALA 181 N 0.76 0.41 -3.91 4.61 0.00 -1.26 -0.05 120.51 121.07 1xi9 n ALA 181 Ca 0.00 -0.13 -0.28 0.00 0.00 0.00 0.00 53.44 53.03 1xi9 n ALA 181 Cb 0.00 -2.23 -0.17 0.00 0.00 0.00 0.00 19.45 17.05 1xi9 n ALA 181 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1xi9 s LEU 182 N -4.12 1.57 0.16 0.00 2.96 -1.26 -1.72 118.68 116.26 1xi9 s LEU 182 Ca 0.78 -0.58 -0.30 0.00 -0.22 0.00 0.00 54.13 53.80 1xi9 s LEU 182 Cb -0.35 -0.94 -0.07 0.00 0.50 0.00 0.00 46.19 45.33 1xi9 s LEU 182 CO 0.46 -0.16 1.05 -0.31 -1.32 0.00 0.00 176.35 176.07 1xi9 s TYR 183 N 1.62 3.69 0.64 5.38 4.12 -1.26 -5.01 117.35 126.54 1xi9 s TYR 183 Ca 0.02 1.68 -0.03 0.00 0.02 0.00 0.00 57.07 58.76 1xi9 s TYR 183 Cb -0.15 -3.19 0.06 0.00 -1.52 0.00 0.00 41.96 37.17 1xi9 s TYR 183 CO -0.08 -0.29 0.91 0.16 0.02 0.00 0.00 175.55 176.28 1xi9 s ASP 184 N -0.12 4.93 0.27 2.29 1.47 -1.26 -4.63 116.67 119.62 1xi9 s ASP 184 Ca 0.48 0.17 0.01 0.00 1.18 0.00 0.00 52.55 54.39 1xi9 s ASP 184 Cb -0.27 -0.88 0.60 0.00 -0.34 0.00 0.00 42.92 42.03 1xi9 s ASP 184 CO 0.33 -1.45 1.74 0.50 0.68 0.00 0.00 175.17 176.97 1xi9 h LYS 185 N -0.32 0.54 0.16 2.11 3.64 -1.96 -2.27 116.57 118.46 1xi9 h LYS 185 Ca -0.43 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 58.92 1xi9 h LYS 185 Cb 1.30 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.99 1xi9 h LYS 185 CO 0.54 0.36 -0.11 -0.22 -2.27 0.00 0.00 179.45 177.75 1xi9 h LYS 186 N 0.56 -0.26 -0.07 1.90 3.64 -1.98 0.22 116.57 120.57 1xi9 h LYS 186 Ca 0.50 0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.93 1xi9 h LYS 186 Cb 0.79 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.63 1xi9 h LYS 186 CO -0.42 -0.17 -0.16 1.15 -2.27 0.00 0.00 179.45 177.58 1xi9 h THR 187 N -0.27 0.59 -0.09 1.00 2.02 -1.87 -0.50 112.91 113.79 1xi9 h THR 187 Ca -0.01 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.17 1xi9 h THR 187 Cb 0.24 0.59 -0.00 0.00 -1.74 0.00 0.00 68.15 67.23 1xi9 h THR 187 CO 0.00 0.00 0.04 -0.07 0.37 0.00 0.00 175.52 175.87 1xi9 h LEU 188 N -0.23 0.12 -0.84 2.58 3.38 -1.26 -0.79 115.31 118.26 1xi9 h LEU 188 Ca 0.08 -0.12 0.10 0.00 0.09 0.00 0.00 57.88 58.02 1xi9 h LEU 188 Cb 0.34 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 40.98 1xi9 h LEU 188 CO -0.21 0.21 0.48 -0.33 0.09 0.00 0.00 178.44 178.68 1xi9 h GLU 189 N 0.02 0.78 -0.19 1.13 4.39 -0.43 -0.94 114.58 119.34 1xi9 h GLU 189 Ca 0.03 -0.05 -0.18 0.00 0.34 0.00 0.00 59.36 59.50 1xi9 h GLU 189 Cb 0.12 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 28.60 1xi9 h GLU 189 CO -0.00 0.52 -0.62 0.93 -1.16 0.00 0.00 179.01 178.67 1xi9 h GLU 190 N 0.80 0.66 -0.65 2.33 5.08 -0.73 -1.36 114.58 120.71 1xi9 h GLU 190 Ca 0.41 -0.46 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1xi9 h GLU 190 Cb 0.38 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.67 1xi9 h GLU 190 CO -0.25 1.08 0.36 0.82 -1.00 0.00 0.00 179.01 180.02 1xi9 h ILE 191 N 0.49 1.20 -0.53 3.13 2.04 -0.83 -2.44 117.51 120.56 1xi9 h ILE 191 Ca -0.01 -0.49 -0.05 0.00 1.00 0.00 0.00 64.86 65.31 1xi9 h ILE 191 Cb 1.20 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 1xi9 h ILE 191 CO 0.12 0.22 0.11 -0.07 0.00 0.00 0.00 178.15 178.53 1xi9 h LEU 192 N 0.88 0.77 -0.11 1.44 3.38 -1.04 -1.50 115.31 119.14 1xi9 h LEU 192 Ca 0.23 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1xi9 h LEU 192 Cb 0.03 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 1xi9 h LEU 192 CO -0.04 0.77 0.04 0.78 0.09 0.00 0.00 178.44 180.09 1xi9 h ASN 193 N 0.79 0.15 -0.56 -0.43 2.35 -1.03 -0.49 115.58 116.36 1xi9 h ASN 193 Ca 0.17 -0.16 0.02 0.00 -0.55 0.00 0.00 56.30 55.78 1xi9 h ASN 193 Cb 0.32 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.62 1xi9 h ASN 193 CO 0.00 0.27 0.35 0.40 -1.65 0.00 0.00 177.43 176.80 1xi9 h ILE 194 N 0.02 1.09 -0.71 2.81 2.04 -1.32 -0.77 117.51 120.67 1xi9 h ILE 194 Ca 0.04 -0.24 -0.07 0.00 1.00 0.00 0.00 64.86 65.59 1xi9 h ILE 194 Cb 0.16 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 1xi9 h ILE 194 CO -0.00 0.13 0.18 0.00 0.00 0.00 0.00 178.15 178.45 1xi9 h ALA 195 N 1.23 0.93 -0.80 1.87 0.00 -1.21 -2.75 119.26 118.53 1xi9 h ALA 195 Ca 0.22 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1xi9 h ALA 195 Cb -0.01 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 1xi9 h ALA 195 CO -0.08 0.65 0.45 0.78 0.00 0.00 0.00 179.25 181.04 1xi9 h GLY 196 N 1.06 1.19 0.61 0.00 0.00 -0.61 -0.02 103.07 105.29 1xi9 h GLY 196 Ca 0.22 -0.53 0.08 0.00 0.00 0.00 0.00 47.33 47.11 1xi9 h GLY 196 CO 0.00 0.51 0.52 -2.09 0.00 0.00 0.00 176.54 175.48 1xi9 h GLU 197 N 1.11 0.87 -0.36 4.80 4.81 -0.87 -2.78 114.58 122.16 1xi9 h GLU 197 Ca 0.28 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 1xi9 h GLU 197 Cb 0.02 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.20 1xi9 h GLU 197 CO -0.05 0.58 0.00 0.66 -0.73 0.00 0.00 179.01 179.47 1xi9 n TYR 198 N -4.67 0.46 -3.43 0.92 4.02 -1.09 -4.96 117.16 108.41 1xi9 n TYR 198 Ca 0.14 -0.23 -0.19 0.00 -0.01 0.00 0.00 57.90 57.61 1xi9 n TYR 198 Cb 0.24 0.00 0.08 0.00 -0.02 0.00 0.00 39.34 39.64 1xi9 n TYR 198 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 1xi9 n GLU 199 N 1.48 -6.81 -4.31 -0.72 4.07 -0.16 -5.02 120.64 109.17 1xi9 n GLU 199 Ca 0.19 0.78 -0.24 0.00 -0.06 0.00 0.00 57.16 57.83 1xi9 n GLU 199 Cb 0.61 -5.63 -0.12 0.00 -0.06 0.00 0.00 31.44 26.23 1xi9 n GLU 199 CO 0.00 0.00 0.00 0.96 -0.06 0.00 0.00 177.13 178.03 1xi9 s ILE 200 N -3.31 1.81 0.56 6.31 -4.36 -0.40 -5.03 121.20 116.78 1xi9 s ILE 200 Ca 0.28 -1.70 -0.16 0.00 -0.26 0.00 0.00 60.65 58.82 1xi9 s ILE 200 Cb -0.12 -1.70 -0.05 0.00 1.25 0.00 0.00 42.46 41.83 1xi9 s ILE 200 CO 0.68 -0.13 1.03 -2.16 0.24 0.00 0.00 174.94 174.59 1xi9 s PRO 201 N -2.22 3.59 -0.16 0.37 0.04 -1.26 -4.50 135.00 130.85 1xi9 s PRO 201 Ca 0.10 1.10 -0.08 0.00 0.04 0.00 0.00 61.00 62.16 1xi9 s PRO 201 Cb -0.09 -2.08 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 1xi9 s PRO 201 CO 0.05 -0.58 0.11 0.08 0.04 0.00 0.00 177.00 176.71 1xi9 s VAL 202 N -2.53 5.26 -0.23 -0.36 1.01 -0.70 -2.18 120.40 120.67 1xi9 s VAL 202 Ca 0.62 0.13 -0.08 0.00 0.00 0.00 0.00 61.98 62.64 1xi9 s VAL 202 Cb -0.13 -3.34 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 1xi9 s VAL 202 CO 0.35 0.52 0.09 -0.63 0.00 0.00 0.00 175.10 175.43 1xi9 s ILE 203 N -0.21 4.70 -0.28 2.22 1.01 0.24 -0.67 121.20 128.20 1xi9 s ILE 203 Ca 0.10 -0.05 -0.03 0.00 0.00 0.00 0.00 60.65 60.67 1xi9 s ILE 203 Cb -0.12 -3.18 0.03 0.00 0.01 0.00 0.00 42.46 39.21 1xi9 s ILE 203 CO 0.01 0.36 -0.01 -0.55 0.00 0.00 0.00 174.94 174.75 1xi9 s SER 204 N 1.20 4.68 -0.38 3.58 0.15 0.31 0.37 113.70 123.62 1xi9 s SER 204 Ca 0.05 -1.00 -0.20 0.00 0.70 0.00 0.00 55.95 55.50 1xi9 s SER 204 Cb -0.14 -1.72 0.01 0.00 -1.71 0.00 0.00 66.02 62.45 1xi9 s SER 204 CO 0.04 -0.19 0.61 -0.62 1.20 0.00 0.00 173.24 174.28 1xi9 s ASP 205 N 1.33 6.37 -0.15 5.45 -1.08 0.21 -1.47 116.67 127.32 1xi9 s ASP 205 Ca -0.01 -0.05 0.17 0.00 -0.52 0.00 0.00 52.55 52.13 1xi9 s ASP 205 Cb -0.18 -2.31 0.34 0.00 -1.46 0.00 0.00 42.92 39.31 1xi9 s ASP 205 CO -0.02 -0.63 1.19 -0.62 0.52 0.00 0.00 175.17 175.61 1xi9 n GLU 206 N 6.05 1.47 -0.25 4.34 1.02 -0.46 -2.17 120.64 130.65 1xi9 n GLU 206 Ca -0.02 -2.77 0.15 0.00 -0.02 0.00 0.00 57.16 54.50 1xi9 n GLU 206 Cb 0.48 -1.56 0.44 0.00 -0.02 0.00 0.00 31.44 30.79 1xi9 n GLU 206 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 1xi9 h ILE 207 N 0.36 0.76 -0.39 -3.67 6.09 -1.86 -1.36 117.51 117.45 1xi9 h ILE 207 Ca 0.01 -0.19 0.00 0.00 -1.37 0.00 0.00 64.86 63.31 1xi9 h ILE 207 Cb 1.05 0.16 0.00 0.00 0.47 0.00 0.00 36.82 38.50 1xi9 h ILE 207 CO 0.03 0.10 0.00 -1.22 -3.07 0.00 0.00 178.15 173.99 1xi9 n TYR 208 N -4.55 0.61 0.00 2.19 4.01 -1.26 -3.99 117.16 114.18 1xi9 n TYR 208 Ca 0.18 -0.28 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 1xi9 n TYR 208 Cb 0.57 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.56 1xi9 n TYR 208 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1xi9 n ASP 209 N 0.64 0.00 -0.34 7.72 2.03 -0.51 -0.95 116.55 125.14 1xi9 n ASP 209 Ca 0.14 0.00 0.14 0.00 0.52 0.00 0.00 54.79 55.59 1xi9 n ASP 209 Cb 0.39 0.00 0.59 0.00 -0.72 0.00 0.00 41.12 41.38 1xi9 n ASP 209 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1xi9 n LEU 210 N -0.22 1.11 -3.22 -2.67 4.77 -1.26 -4.41 117.00 111.10 1xi9 n LEU 210 Ca 0.00 -0.35 -0.36 0.00 -0.03 0.00 0.00 56.01 55.27 1xi9 n LEU 210 Cb 0.00 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.04 1xi9 n LEU 210 CO 0.00 0.19 2.33 0.80 -1.33 0.00 0.00 177.39 179.38 1xi9 n MET 211 N -0.21 4.00 -4.29 3.23 1.56 -0.12 -4.92 117.12 116.36 1xi9 n MET 211 Ca 0.19 -3.03 -0.25 0.00 -0.27 0.00 0.00 57.70 54.34 1xi9 n MET 211 Cb 0.31 -2.53 -0.08 0.00 2.15 0.00 0.00 33.22 33.06 1xi9 n MET 211 CO 0.00 0.00 0.00 0.95 -0.73 0.00 0.00 175.97 176.19 1xi9 s THR 212 N -0.93 3.29 -0.17 1.12 -4.23 -1.26 -1.49 115.64 111.96 1xi9 s THR 212 Ca 0.57 -1.76 -0.02 0.00 -1.18 0.00 0.00 61.69 59.30 1xi9 s THR 212 Cb 0.23 -2.68 -0.10 0.00 1.34 0.00 0.00 72.50 71.29 1xi9 s THR 212 CO -0.11 -0.21 -0.17 -1.22 -0.54 0.00 0.00 174.62 172.36 1xi9 n TYR 213 N -0.32 0.00 -3.67 3.99 4.02 -0.59 -4.93 117.16 115.65 1xi9 n TYR 213 Ca -0.09 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.54 1xi9 n TYR 213 Cb 0.57 -0.64 -0.17 0.00 -0.02 0.00 0.00 39.34 39.08 1xi9 n TYR 213 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 176.86 174.02 1xi9 s GLU 214 N -2.33 0.32 0.00 -0.72 1.03 -1.26 -5.08 118.70 110.65 1xi9 s GLU 214 Ca -0.23 -0.17 0.00 0.00 0.03 0.00 0.00 54.97 54.60 1xi9 s GLU 214 Cb 0.07 -1.79 0.00 0.00 -0.80 0.00 0.00 34.13 31.61 1xi9 s GLU 214 CO 0.36 -0.61 0.00 0.41 -1.33 0.00 0.00 175.26 174.10 1xi9 n GLY 215 N 5.18 -1.52 3.77 -3.83 0.00 -1.26 -5.04 105.19 102.50 1xi9 n GLY 215 Ca -0.07 -1.16 -0.35 0.00 0.00 0.00 0.00 46.02 44.43 1xi9 n GLY 215 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xi9 s GLU 216 N -4.66 3.36 0.49 1.61 2.02 -1.26 -4.92 118.70 115.34 1xi9 s GLU 216 Ca 0.00 1.66 -0.22 0.00 0.02 0.00 0.00 54.97 56.43 1xi9 s GLU 216 Cb 0.00 -2.05 -0.07 0.00 0.10 0.00 0.00 34.13 32.12 1xi9 s GLU 216 CO 0.00 -0.85 1.20 -1.58 0.02 0.00 0.00 175.26 174.05 1xi9 s HIS 217 N -1.72 2.72 -0.09 1.61 5.65 -1.26 -5.05 115.29 117.15 1xi9 s HIS 217 Ca 0.72 1.50 0.02 0.00 0.25 0.00 0.00 55.06 57.56 1xi9 s HIS 217 Cb -0.25 -3.46 0.01 0.00 -1.18 0.00 0.00 32.58 27.70 1xi9 s HIS 217 CO 0.29 -1.82 -0.15 0.42 -0.65 0.00 0.00 174.74 172.83 1xi9 s ILE 218 N -1.51 1.42 -0.01 0.89 1.01 -1.26 -5.11 121.20 116.62 1xi9 s ILE 218 Ca 0.66 -0.62 -0.20 0.00 0.00 0.00 0.00 60.65 60.49 1xi9 s ILE 218 Cb -0.31 -1.28 -0.05 0.00 0.01 0.00 0.00 42.46 40.83 1xi9 s ILE 218 CO 0.37 0.42 0.56 -0.55 0.00 0.00 0.00 174.94 175.74 1xi9 s SER 219 N 0.77 6.93 0.64 3.58 0.15 -1.26 -4.97 113.70 119.53 1xi9 s SER 219 Ca -0.12 1.11 0.39 0.00 0.70 0.00 0.00 55.95 58.03 1xi9 s SER 219 Cb -0.16 -2.35 2.18 0.00 -1.71 0.00 0.00 66.02 63.99 1xi9 s SER 219 CO 0.02 0.12 2.32 1.55 1.20 0.00 0.00 173.24 178.45 1xi9 h PRO 220 N 5.61 0.00 0.00 5.44 0.13 -1.99 -1.29 132.00 139.90 1xi9 h PRO 220 Ca -0.46 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1xi9 h PRO 220 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1xi9 h PRO 220 CO 0.69 0.00 -0.01 0.78 -0.23 0.00 0.00 178.00 179.23 1xi9 h GLY 221 N 0.06 0.00 2.00 1.56 0.00 -1.96 -1.68 103.07 103.06 1xi9 h GLY 221 Ca -0.00 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.17 1xi9 h GLY 221 CO 0.00 0.00 -0.75 1.76 0.00 0.00 0.00 176.54 177.55 1xi9 h SER 222 N 0.00 0.00 0.00 0.19 0.02 -1.46 -3.36 113.55 108.94 1xi9 h SER 222 Ca -0.00 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.80 1xi9 h SER 222 Cb 0.02 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.54 1xi9 h SER 222 CO 0.00 0.75 -2.10 0.18 -1.14 0.00 0.00 176.83 174.52 1xi9 n LEU 223 N -3.53 0.00 -4.75 5.07 4.77 -1.01 -4.98 117.00 112.57 1xi9 n LEU 223 Ca -0.00 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.62 1xi9 n LEU 223 Cb 0.76 0.20 0.03 0.00 -2.33 0.00 0.00 43.42 42.08 1xi9 n LEU 223 CO 0.44 0.20 0.83 0.28 -1.33 0.00 0.00 177.39 177.80 1xi9 s THR 224 N -3.03 2.69 -0.01 -5.08 -1.32 -0.66 -4.98 115.64 103.25 1xi9 s THR 224 Ca -0.08 0.42 -0.05 0.00 -1.21 0.00 0.00 61.69 60.77 1xi9 s THR 224 Cb 0.10 -3.15 -0.02 0.00 -1.51 0.00 0.00 72.50 67.93 1xi9 s THR 224 CO 0.83 -0.10 -0.10 0.29 -2.21 0.00 0.00 174.62 173.32 1xi9 n LYS 225 N -1.65 0.16 -0.12 7.08 4.01 -1.26 -4.92 118.16 121.46 1xi9 n LYS 225 Ca 0.13 0.06 -0.15 0.00 -0.51 0.00 0.00 58.31 57.84 1xi9 n LYS 225 Cb 0.50 -0.69 -0.12 0.00 -0.51 0.00 0.00 35.03 34.21 1xi9 n LYS 225 CO 0.00 0.00 0.00 -0.40 -1.11 0.00 0.00 177.40 175.89 1xi9 n ASP 226 N -3.48 1.65 -4.70 4.39 5.68 -1.26 -4.77 116.55 114.06 1xi9 n ASP 226 Ca -0.04 -0.10 -0.42 0.00 -0.50 0.00 0.00 54.79 53.72 1xi9 n ASP 226 Cb 0.15 -0.08 -0.03 0.00 -1.14 0.00 0.00 41.12 40.02 1xi9 n ASP 226 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1xi9 s VAL 227 N -2.49 2.51 0.14 2.12 1.01 -1.26 -4.78 120.40 117.65 1xi9 s VAL 227 Ca -0.28 0.10 -0.30 0.00 0.00 0.00 0.00 61.98 61.50 1xi9 s VAL 227 Cb 0.08 -3.06 -0.07 0.00 0.00 0.00 0.00 36.38 33.32 1xi9 s VAL 227 CO 0.62 0.00 1.14 -2.16 0.00 0.00 0.00 175.10 174.71 1xi9 s PRO 228 N 2.44 4.53 -0.07 2.72 0.04 -1.26 -4.81 135.00 138.59 1xi9 s PRO 228 Ca 0.79 1.75 0.03 0.00 0.04 0.00 0.00 61.00 63.62 1xi9 s PRO 228 Cb -0.46 -3.29 -0.02 0.00 0.04 0.00 0.00 34.50 30.77 1xi9 s PRO 228 CO 0.35 -0.05 -0.17 0.08 0.04 0.00 0.00 177.00 177.25 1xi9 s VAL 229 N 0.18 2.82 -0.32 -0.36 1.01 0.56 -1.72 120.40 122.57 1xi9 s VAL 229 Ca 0.53 -0.79 -0.04 0.00 0.00 0.00 0.00 61.98 61.68 1xi9 s VAL 229 Cb -0.30 -2.11 0.05 0.00 0.00 0.00 0.00 36.38 34.02 1xi9 s VAL 229 CO 0.34 0.57 0.05 -0.63 0.00 0.00 0.00 175.10 175.42 1xi9 s ILE 230 N -0.38 3.33 -0.10 2.22 1.01 0.15 -0.90 121.20 126.54 1xi9 s ILE 230 Ca 0.04 -1.28 -0.15 0.00 0.00 0.00 0.00 60.65 59.26 1xi9 s ILE 230 Cb -0.12 -2.91 -0.05 0.00 0.01 0.00 0.00 42.46 39.39 1xi9 s ILE 230 CO 0.02 -0.14 0.37 -0.69 0.00 0.00 0.00 174.94 174.50 1xi9 s VAL 231 N 1.32 5.19 -0.01 2.92 1.01 0.02 -0.53 120.40 130.33 1xi9 s VAL 231 Ca -0.04 0.74 0.08 0.00 0.00 0.00 0.00 61.98 62.76 1xi9 s VAL 231 Cb -0.20 -3.70 -0.02 0.00 0.00 0.00 0.00 36.38 32.46 1xi9 s VAL 231 CO 0.01 0.44 -0.26 -0.04 0.00 0.00 0.00 175.10 175.25 1xi9 s MET 232 N -0.06 2.05 0.37 2.72 -1.94 -0.54 -0.25 119.30 121.65 1xi9 s MET 232 Ca 0.21 -0.96 -0.14 0.00 -1.71 0.00 0.00 55.69 53.09 1xi9 s MET 232 Cb -0.15 -2.04 0.04 0.00 2.01 0.00 0.00 34.83 34.70 1xi9 s MET 232 CO 0.09 0.55 0.73 1.21 -0.01 0.00 0.00 175.02 177.59 1xi9 s ASN 233 N -0.76 0.14 0.00 3.03 3.84 -0.55 -1.35 114.94 119.29 1xi9 s ASN 233 Ca 0.10 -1.17 0.00 0.00 0.21 0.00 0.00 52.86 52.01 1xi9 s ASN 233 Cb -0.10 0.81 0.00 0.00 -0.55 0.00 0.00 41.25 41.41 1xi9 s ASN 233 CO -0.00 -1.60 0.00 0.61 -2.79 0.00 0.00 177.10 173.32 1xi9 n GLY 234 N -0.53 -1.29 0.19 1.21 0.00 -1.26 -0.75 105.19 102.76 1xi9 n GLY 234 Ca -0.06 -0.91 0.12 0.00 0.00 0.00 0.00 46.02 45.17 1xi9 n GLY 234 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xi9 n LEU 235 N 0.00 0.95 -0.16 0.99 4.77 -0.85 -4.54 117.00 118.16 1xi9 n LEU 235 Ca 0.00 -0.23 -0.07 0.00 -0.03 0.00 0.00 56.01 55.67 1xi9 n LEU 235 Cb 0.00 -0.14 0.01 0.00 -2.33 0.00 0.00 43.42 40.96 1xi9 n LEU 235 CO 0.00 0.19 1.06 0.28 -1.33 0.00 0.00 177.39 177.58 1xi9 h SER 236 N 0.92 0.56 0.00 -1.43 0.02 -1.77 -1.84 113.55 110.00 1xi9 h SER 236 Ca 0.00 -0.04 -0.08 0.00 -0.84 0.00 0.00 61.79 60.83 1xi9 h SER 236 Cb 0.52 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 1xi9 h SER 236 CO 0.00 0.43 -1.10 0.29 -1.14 0.00 0.00 176.83 175.31 1xi9 n LYS 237 N -4.73 0.42 0.24 3.45 4.76 -1.26 -2.42 118.16 118.62 1xi9 n LYS 237 Ca 0.02 0.17 0.09 0.00 -2.87 0.00 0.00 58.31 55.71 1xi9 n LYS 237 Cb 0.04 -1.22 0.61 0.00 -1.84 0.00 0.00 35.03 32.62 1xi9 n LYS 237 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1xi9 h VAL 238 N -0.77 0.90 -0.17 -0.18 2.07 -1.78 -2.86 116.25 113.47 1xi9 h VAL 238 Ca -0.13 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 66.87 1xi9 h VAL 238 Cb 0.93 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 32.00 1xi9 h VAL 238 CO -0.08 0.14 0.00 -1.22 0.02 0.00 0.00 177.57 176.43 1xi9 n TYR 239 N -4.08 0.23 -4.01 1.57 4.01 -1.18 -4.94 117.16 108.77 1xi9 n TYR 239 Ca -0.02 -0.50 -0.26 0.00 -0.16 0.00 0.00 57.90 56.96 1xi9 n TYR 239 Cb 0.22 -0.04 -0.03 0.00 -0.31 0.00 0.00 39.34 39.18 1xi9 n TYR 239 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1xi9 n PHE 240 N 0.02 -1.59 -2.74 -0.72 3.72 -1.08 -4.18 117.46 110.89 1xi9 n PHE 240 Ca 0.06 0.72 -0.15 0.00 -0.05 0.00 0.00 57.45 58.02 1xi9 n PHE 240 Cb 0.34 -3.59 0.01 0.00 -0.94 0.00 0.00 39.48 35.30 1xi9 n PHE 240 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1xi9 n ALA 241 N -4.43 3.57 -0.28 4.37 0.00 -0.71 -2.33 120.51 120.69 1xi9 n ALA 241 Ca -0.31 -3.52 -0.05 0.00 0.00 0.00 0.00 53.44 49.56 1xi9 n ALA 241 Cb 0.69 -0.84 0.07 0.00 0.00 0.00 0.00 19.45 19.36 1xi9 n ALA 241 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1xi9 h THR 242 N 2.55 1.21 0.00 0.00 1.35 -1.77 -2.91 112.91 113.33 1xi9 h THR 242 Ca 0.03 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 1xi9 h THR 242 Cb 1.04 0.10 0.00 0.00 -1.73 0.00 0.00 68.15 67.57 1xi9 h THR 242 CO 0.59 0.21 0.00 0.61 -0.25 0.00 0.00 175.52 176.68 1xi9 n GLY 243 N -1.26 -0.96 0.04 5.82 0.00 -1.26 -3.41 105.19 104.15 1xi9 n GLY 243 Ca 0.07 -0.18 0.11 0.00 0.00 0.00 0.00 46.02 46.02 1xi9 n GLY 243 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1xi9 n TRP 244 N -0.97 0.28 -3.61 1.61 7.02 -1.10 -5.02 117.44 115.65 1xi9 n TRP 244 Ca 0.22 0.08 -0.23 0.00 -1.02 0.00 0.00 57.50 56.55 1xi9 n TRP 244 Cb 0.10 -0.46 0.04 0.00 -2.42 0.00 0.00 31.31 28.57 1xi9 n TRP 244 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 1xi9 n ARG 245 N -2.02 -3.38 -4.14 -0.99 5.12 -1.22 -4.94 116.66 105.10 1xi9 n ARG 245 Ca 0.01 0.62 -0.17 0.00 -1.93 0.00 0.00 57.85 56.39 1xi9 n ARG 245 Cb 0.45 -5.00 -0.15 0.00 -1.16 0.00 0.00 32.46 26.60 1xi9 n ARG 245 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 1xi9 s LEU 246 N -6.38 1.80 0.00 0.55 2.96 -1.26 -2.73 118.68 113.62 1xi9 s LEU 246 Ca 0.22 -0.09 0.00 0.00 -0.22 0.00 0.00 54.13 54.04 1xi9 s LEU 246 Cb -0.06 -0.29 0.00 0.00 0.50 0.00 0.00 46.19 46.34 1xi9 s LEU 246 CO 0.81 0.03 0.00 0.61 -1.32 0.00 0.00 176.35 176.48 1xi9 n GLY 247 N 3.27 2.10 3.78 7.98 0.00 -0.60 -2.01 105.19 119.71 1xi9 n GLY 247 Ca -0.17 -0.88 -0.07 0.00 0.00 0.00 0.00 46.02 44.90 1xi9 n GLY 247 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xi9 s TYR 248 N -5.91 -0.23 0.06 1.61 1.13 0.07 -1.15 117.35 112.93 1xi9 s TYR 248 Ca 0.00 -0.17 0.01 0.00 -1.41 0.00 0.00 57.07 55.50 1xi9 s TYR 248 Cb 0.00 0.68 -0.03 0.00 -1.10 0.00 0.00 41.96 41.50 1xi9 s TYR 248 CO 0.00 -1.12 -0.06 0.00 -2.51 0.00 0.00 175.55 171.87 1xi9 s MET 249 N -3.79 0.65 0.07 -3.49 0.23 -0.09 -1.48 119.30 111.40 1xi9 s MET 249 Ca 0.10 -1.09 -0.10 0.00 -1.03 0.00 0.00 55.69 53.57 1xi9 s MET 249 Cb -0.05 -0.10 0.01 0.00 -1.53 0.00 0.00 34.83 33.16 1xi9 s MET 249 CO 0.03 -0.03 0.22 1.52 -2.03 0.00 0.00 175.02 174.74 1xi9 s TYR 250 N -2.90 0.07 -0.18 3.16 -0.85 0.65 -0.88 117.35 116.43 1xi9 s TYR 250 Ca 0.02 -0.40 -0.04 0.00 -0.52 0.00 0.00 57.07 56.14 1xi9 s TYR 250 Cb 0.00 -0.01 -0.02 0.00 0.38 0.00 0.00 41.96 42.31 1xi9 s TYR 250 CO -0.04 -0.52 -0.04 -0.06 -1.52 0.00 0.00 175.55 173.37 1xi9 s PHE 251 N -3.34 2.98 -0.42 -3.49 0.08 -0.69 -0.80 117.98 112.30 1xi9 s PHE 251 Ca 0.01 -0.50 -0.09 0.00 0.12 0.00 0.00 56.93 56.46 1xi9 s PHE 251 Cb 0.02 -2.00 0.08 0.00 -0.57 0.00 0.00 43.02 40.55 1xi9 s PHE 251 CO -0.08 -0.21 0.26 0.08 -0.10 0.00 0.00 175.22 175.17 1xi9 s VAL 252 N 0.73 4.26 -0.49 -0.44 1.01 -0.08 -4.94 120.40 120.45 1xi9 s VAL 252 Ca -0.02 -1.39 0.06 0.00 0.00 0.00 0.00 61.98 60.63 1xi9 s VAL 252 Cb -0.15 -3.61 0.24 0.00 0.00 0.00 0.00 36.38 32.87 1xi9 s VAL 252 CO 0.02 -0.51 0.87 -0.67 0.00 0.00 0.00 175.10 174.82 1xi9 n ASP 253 N 4.92 -2.94 -0.23 3.32 2.03 -1.26 -0.33 116.55 122.07 1xi9 n ASP 253 Ca -0.10 -3.28 -0.03 0.00 0.52 0.00 0.00 54.79 51.91 1xi9 n ASP 253 Cb 0.43 1.82 0.08 0.00 -0.72 0.00 0.00 41.12 42.73 1xi9 n ASP 253 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1xi9 h PRO 254 N 4.08 0.72 0.00 -0.67 0.13 -1.87 -2.42 132.00 131.96 1xi9 h PRO 254 Ca -0.13 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1xi9 h PRO 254 Cb 1.04 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1xi9 h PRO 254 CO 0.31 0.47 0.00 0.39 -0.23 0.00 0.00 178.00 178.94 1xi9 n GLU 255 N -4.74 0.75 -3.27 0.86 1.02 -1.26 -4.89 120.64 109.11 1xi9 n GLU 255 Ca 0.08 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.99 1xi9 n GLU 255 Cb 0.13 -1.06 0.00 0.00 -0.02 0.00 0.00 31.44 30.49 1xi9 n GLU 255 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1xi9 n ASN 256 N -0.56 -4.13 0.25 1.62 3.02 -0.91 -4.88 115.26 109.66 1xi9 n ASN 256 Ca 0.02 -0.35 0.12 0.00 -0.03 0.00 0.00 54.58 54.34 1xi9 n ASN 256 Cb 0.01 -3.40 0.63 0.00 -0.61 0.00 0.00 39.78 36.41 1xi9 n ASN 256 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1xi9 h LYS 257 N -1.01 0.00 -0.63 3.52 1.57 -1.90 -3.07 116.57 115.05 1xi9 h LYS 257 Ca -0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1xi9 h LYS 257 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 1xi9 h LYS 257 CO 0.53 0.16 0.00 1.28 -0.57 0.00 0.00 179.45 180.85 1xi9 n LEU 258 N -3.56 3.93 -0.20 2.94 4.77 -1.26 -4.65 117.00 118.96 1xi9 n LEU 258 Ca -0.01 -1.98 0.03 0.00 -0.03 0.00 0.00 56.01 54.02 1xi9 n LEU 258 Cb 0.30 -0.51 0.29 0.00 -2.33 0.00 0.00 43.42 41.17 1xi9 n LEU 258 CO 0.31 0.69 1.23 0.77 -1.33 0.00 0.00 177.39 179.06 1xi9 h SER 259 N 3.36 0.78 0.01 -1.43 4.64 -1.94 0.31 113.55 119.27 1xi9 h SER 259 Ca 0.00 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1xi9 h SER 259 Cb 1.20 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1xi9 h SER 259 CO 0.18 0.54 -0.00 -0.08 -0.87 0.00 0.00 176.83 176.59 1xi9 h GLU 260 N 0.90 -0.01 -0.82 4.77 4.81 -1.88 -1.86 114.58 120.49 1xi9 h GLU 260 Ca 0.30 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.60 1xi9 h GLU 260 Cb 0.05 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.37 1xi9 h GLU 260 CO -0.08 0.30 0.49 0.28 -0.73 0.00 0.00 179.01 179.26 1xi9 h VAL 261 N -0.31 0.97 -0.58 0.32 2.07 -1.69 -0.71 116.25 116.32 1xi9 h VAL 261 Ca -0.00 -0.29 -0.04 0.00 0.82 0.00 0.00 66.70 67.19 1xi9 h VAL 261 Cb 0.31 0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 30.09 1xi9 h VAL 261 CO 0.00 0.16 0.22 0.03 0.02 0.00 0.00 177.57 177.99 1xi9 h ARG 262 N 0.86 0.87 -0.98 1.57 3.08 -0.38 0.96 114.38 120.36 1xi9 h ARG 262 Ca 0.38 -0.17 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1xi9 h ARG 262 Cb 0.27 -0.14 -0.05 0.00 0.08 0.00 0.00 29.97 30.13 1xi9 h ARG 262 CO -0.21 0.76 0.62 1.49 -1.07 0.00 0.00 179.97 181.56 1xi9 h GLU 263 N 0.80 1.31 -0.43 0.04 4.81 -0.87 -0.08 114.58 120.15 1xi9 h GLU 263 Ca 0.19 -0.10 -0.04 0.00 -0.13 0.00 0.00 59.36 59.28 1xi9 h GLU 263 Cb 0.22 -0.28 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 1xi9 h GLU 263 CO -0.01 0.89 0.10 0.00 -0.73 0.00 0.00 179.01 179.26 1xi9 h ALA 264 N 1.34 0.57 -0.63 2.92 0.00 -0.57 -2.47 119.26 120.43 1xi9 h ALA 264 Ca 0.35 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 55.11 1xi9 h ALA 264 Cb -0.11 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.47 1xi9 h ALA 264 CO -0.07 0.25 0.36 0.82 0.00 0.00 0.00 179.25 180.61 1xi9 h ILE 265 N 0.56 1.00 -0.97 0.00 2.04 -0.28 -2.55 117.51 117.31 1xi9 h ILE 265 Ca 0.14 -0.23 0.02 0.00 1.00 0.00 0.00 64.86 65.78 1xi9 h ILE 265 Cb 0.32 0.27 -0.05 0.00 -0.74 0.00 0.00 36.82 36.62 1xi9 h ILE 265 CO 0.00 0.12 0.64 0.44 0.00 0.00 0.00 178.15 179.36 1xi9 h ASP 266 N 0.67 1.10 -0.27 1.72 3.45 -0.89 0.26 116.42 122.47 1xi9 h ASP 266 Ca 0.27 -0.02 -0.01 0.00 0.43 0.00 0.00 57.03 57.70 1xi9 h ASP 266 Cb 0.13 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.61 1xi9 h ASP 266 CO -0.15 0.79 0.14 0.03 -1.57 0.00 0.00 179.24 178.47 1xi9 h ARG 267 N 1.30 0.38 -0.53 3.56 3.08 -1.19 -1.49 114.38 119.49 1xi9 h ARG 267 Ca 0.36 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.32 1xi9 h ARG 267 Cb -0.12 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 29.84 1xi9 h ARG 267 CO -0.09 0.35 0.18 -0.07 -1.07 0.00 0.00 179.97 179.27 1xi9 h LEU 268 N 0.31 0.76 -1.02 3.04 3.38 -1.27 -2.78 115.31 117.74 1xi9 h LEU 268 Ca 0.09 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.87 1xi9 h LEU 268 Cb 0.09 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.60 1xi9 h LEU 268 CO -0.01 0.76 0.62 0.00 0.09 0.00 0.00 178.44 179.90 1xi9 h ALA 269 N 1.04 1.28 -0.38 1.53 0.00 -0.91 -3.06 119.26 118.76 1xi9 h ALA 269 Ca 0.17 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1xi9 h ALA 269 Cb 0.26 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1xi9 h ALA 269 CO -0.01 0.65 -0.11 0.00 0.00 0.00 0.00 179.25 179.79 1xi9 h ARG 270 N 1.31 0.74 0.00 0.00 3.08 -1.09 -2.91 114.38 115.51 1xi9 h ARG 270 Ca 0.35 -0.29 -0.08 0.00 0.07 0.00 0.00 59.98 60.03 1xi9 h ARG 270 Cb -0.12 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 1xi9 h ARG 270 CO -0.07 0.89 -0.37 0.97 -1.07 0.00 0.00 179.97 180.32 1xi9 h ILE 271 N 0.54 1.04 -0.00 2.04 2.10 -1.51 -2.31 117.51 119.42 1xi9 h ILE 271 Ca 0.09 -1.38 0.00 0.00 1.08 0.00 0.00 64.86 64.65 1xi9 h ILE 271 Cb 0.63 1.80 0.00 0.00 -1.09 0.00 0.00 36.82 38.16 1xi9 h ILE 271 CO 0.04 0.36 -0.08 -1.14 -1.08 0.00 0.00 178.15 176.25 1xi9 n ARG 272 N -3.77 0.82 0.00 2.19 0.00 -1.16 -5.00 116.66 109.74 1xi9 n ARG 272 Ca -0.01 -0.27 0.00 0.00 -0.00 0.00 0.00 57.85 57.57 1xi9 n ARG 272 Cb 0.45 -1.49 0.00 0.00 0.00 0.00 0.00 32.46 31.42 1xi9 n ARG 272 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1xi9 n LEU 273 N -0.85 0.00 -3.71 6.15 4.77 -0.87 -4.89 117.00 117.60 1xi9 n LEU 273 Ca 0.16 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 56.09 1xi9 n LEU 273 Cb 0.26 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.34 1xi9 n LEU 273 CO 0.22 0.00 0.65 0.00 -1.33 0.00 0.00 177.39 176.93 1xi9 n PRO 275 N -0.42 -0.53 -1.74 0.00 -0.04 -1.26 -4.99 135.00 126.01 1xi9 n PRO 275 Ca -0.07 -1.38 -0.42 0.00 -0.04 0.00 0.00 63.50 61.59 1xi9 n PRO 275 Cb 0.61 -0.72 -0.03 0.00 -0.04 0.00 0.00 33.50 33.32 1xi9 n PRO 275 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1xi9 s ASN 276 N -3.86 6.42 -0.01 3.54 3.84 -1.26 -4.70 114.94 118.91 1xi9 s ASN 276 Ca 0.45 2.79 -0.16 0.00 0.21 0.00 0.00 52.86 56.14 1xi9 s ASN 276 Cb -0.02 -2.58 -0.09 0.00 -0.55 0.00 0.00 41.25 38.01 1xi9 s ASN 276 CO 0.31 -0.97 0.76 0.74 -2.79 0.00 0.00 177.10 175.15 1xi9 h THR 277 N 4.26 0.00 -0.25 -5.21 2.02 -1.87 -3.32 112.91 108.55 1xi9 h THR 277 Ca -0.44 -0.41 0.01 0.00 0.77 0.00 0.00 66.41 66.34 1xi9 h THR 277 Cb 1.21 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 1xi9 h THR 277 CO 0.95 0.00 0.17 1.55 0.37 0.00 0.00 175.52 178.55 1xi9 h PRO 278 N -1.00 0.29 -0.04 6.66 0.13 -1.92 -0.89 132.00 135.24 1xi9 h PRO 278 Ca -0.06 -0.02 0.01 0.00 -0.87 0.00 0.00 66.00 65.06 1xi9 h PRO 278 Cb 0.45 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 31.52 1xi9 h PRO 278 CO 0.10 0.19 0.03 0.00 -0.23 0.00 0.00 178.00 178.09 1xi9 h ALA 279 N 1.85 1.77 0.00 -0.56 0.00 -1.90 -1.96 119.26 118.46 1xi9 h ALA 279 Ca 0.09 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1xi9 h ALA 279 Cb 0.02 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1xi9 h ALA 279 CO -0.02 -0.05 -0.09 1.96 0.00 0.00 0.00 179.25 181.05 1xi9 h GLN 280 N 0.00 0.00 -0.02 0.00 4.20 -1.25 -0.44 115.11 117.60 1xi9 h GLN 280 Ca 0.02 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.48 1xi9 h GLN 280 Cb 0.08 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.88 1xi9 h GLN 280 CO -0.00 0.09 -0.96 0.74 -0.67 0.00 0.00 178.83 178.03 1xi9 h PHE 281 N 0.00 0.89 -0.93 2.96 -1.00 -1.45 -2.44 116.94 114.97 1xi9 h PHE 281 Ca -0.00 -0.47 -0.00 0.00 2.81 0.00 0.00 57.97 60.31 1xi9 h PHE 281 Cb 0.70 -0.11 -0.05 0.00 3.61 0.00 0.00 35.95 40.10 1xi9 h PHE 281 CO 0.00 1.30 0.58 0.00 -1.61 0.00 0.00 178.31 178.58 1xi9 h ALA 282 N 0.55 1.27 -0.50 2.45 0.00 -1.30 -1.85 119.26 119.88 1xi9 h ALA 282 Ca -0.10 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.61 1xi9 h ALA 282 Cb 1.60 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 1xi9 h ALA 282 CO 0.18 0.64 -0.13 0.00 0.00 0.00 0.00 179.25 179.95 1xi9 h ALA 283 N 1.36 0.69 -0.52 0.00 0.00 -1.10 -0.67 119.26 119.02 1xi9 h ALA 283 Ca 0.34 -0.35 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1xi9 h ALA 283 Cb -0.09 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.49 1xi9 h ALA 283 CO -0.07 0.62 0.29 0.82 0.00 0.00 0.00 179.25 180.91 1xi9 h ILE 284 N 0.84 1.02 -0.73 0.00 2.04 -1.18 -0.73 117.51 118.77 1xi9 h ILE 284 Ca 0.13 -0.20 -0.00 0.00 1.00 0.00 0.00 64.86 65.78 1xi9 h ILE 284 Cb 0.69 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 37.13 1xi9 h ILE 284 CO 0.05 0.11 0.44 0.00 0.00 0.00 0.00 178.15 178.75 1xi9 h ALA 285 N 1.25 0.93 -0.50 1.87 0.00 -1.01 -0.79 119.26 121.00 1xi9 h ALA 285 Ca 0.21 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 1xi9 h ALA 285 Cb 0.06 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1xi9 h ALA 285 CO -0.11 0.40 -0.11 0.78 0.00 0.00 0.00 179.25 180.20 1xi9 h GLY 286 N 1.00 1.05 1.01 0.00 0.00 -0.84 -0.71 103.07 104.58 1xi9 h GLY 286 Ca 0.26 -0.86 -0.20 0.00 0.00 0.00 0.00 47.33 46.54 1xi9 h GLY 286 CO -0.05 0.78 -0.73 1.41 0.00 0.00 0.00 176.54 177.95 1xi9 h LEU 287 N 0.83 0.76 -1.90 3.11 3.38 -1.02 -3.32 115.31 117.15 1xi9 h LEU 287 Ca 0.13 -0.69 0.00 0.00 0.09 0.00 0.00 57.88 57.41 1xi9 h LEU 287 Cb 0.67 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1xi9 h LEU 287 CO 0.05 1.34 0.00 0.35 0.09 0.00 0.00 178.44 180.27 1xi9 n THR 288 N -4.06 0.30 -2.87 0.22 -2.24 -0.31 -4.87 114.28 100.46 1xi9 n THR 288 Ca -0.09 -0.58 -0.14 0.00 -2.27 0.00 0.00 64.05 60.97 1xi9 n THR 288 Cb 0.73 0.93 0.06 0.00 -2.10 0.00 0.00 70.33 69.94 1xi9 n THR 288 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xi9 n GLY 289 N 1.38 1.58 3.74 3.38 0.00 -0.27 -5.02 105.19 109.97 1xi9 n GLY 289 Ca 0.18 -2.14 -0.41 0.00 0.00 0.00 0.00 46.02 43.65 1xi9 n GLY 289 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xi9 s PRO 290 N -3.89 4.49 -0.16 1.61 0.04 -1.26 -4.95 135.00 130.88 1xi9 s PRO 290 Ca 0.42 1.87 0.09 0.00 0.04 0.00 0.00 61.00 63.42 1xi9 s PRO 290 Cb -0.03 -3.24 0.55 0.00 0.04 0.00 0.00 34.50 31.82 1xi9 s PRO 290 CO 0.27 -0.08 1.34 -1.33 0.04 0.00 0.00 177.00 177.24 1xi9 n MET 291 N 2.52 3.62 -0.22 4.56 2.81 -1.26 -4.46 117.12 124.68 1xi9 n MET 291 Ca 0.04 -2.12 -0.05 0.00 -1.81 0.00 0.00 57.70 53.76 1xi9 n MET 291 Cb 0.45 -2.01 0.11 0.00 -0.71 0.00 0.00 33.22 31.05 1xi9 n MET 291 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 1xi9 h ASP 292 N 2.69 0.98 -0.86 7.83 5.19 -2.01 -2.26 116.42 127.98 1xi9 h ASP 292 Ca 0.00 -0.18 0.18 0.00 -0.62 0.00 0.00 57.03 56.41 1xi9 h ASP 292 Cb 1.49 -0.26 -0.11 0.00 0.18 0.00 0.00 39.33 40.63 1xi9 h ASP 292 CO 0.33 0.92 0.39 0.10 -3.12 0.00 0.00 179.24 177.86 1xi9 h TYR 293 N 1.00 0.66 -0.13 4.55 -0.00 -2.01 -2.94 116.97 118.10 1xi9 h TYR 293 Ca 0.22 0.04 -0.08 0.00 -0.00 0.00 0.00 58.73 58.90 1xi9 h TYR 293 Cb 0.30 -0.16 0.00 0.00 -0.00 0.00 0.00 36.73 36.87 1xi9 h TYR 293 CO 0.02 0.04 -0.24 1.25 -0.00 0.00 0.00 178.16 179.23 1xi9 h LEU 294 N 0.48 0.44 -0.80 0.10 5.85 -1.75 -2.37 115.31 117.26 1xi9 h LEU 294 Ca 0.50 -0.55 0.18 0.00 0.84 0.00 0.00 57.88 58.86 1xi9 h LEU 294 Cb 0.85 -0.13 -0.14 0.00 0.37 0.00 0.00 40.66 41.61 1xi9 h LEU 294 CO -0.46 0.91 -0.03 0.50 -0.34 0.00 0.00 178.44 179.03 1xi9 h LYS 295 N -0.01 0.07 -0.27 1.25 1.63 -1.40 0.17 116.57 118.01 1xi9 h LYS 295 Ca 0.01 -0.00 -0.15 0.00 -0.85 0.00 0.00 60.65 59.65 1xi9 h LYS 295 Cb 0.83 -0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 32.44 1xi9 h LYS 295 CO 0.05 0.05 -0.42 1.49 -3.45 0.00 0.00 179.45 177.17 1xi9 h GLU 296 N 0.07 0.76 -0.49 1.90 4.81 -1.42 -2.58 114.58 117.63 1xi9 h GLU 296 Ca 0.44 -0.46 -0.12 0.00 -0.13 0.00 0.00 59.36 59.09 1xi9 h GLU 296 Cb 0.78 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 1xi9 h GLU 296 CO -0.73 1.08 -0.16 1.88 -0.73 0.00 0.00 179.01 180.35 1xi9 h TYR 297 N 0.50 1.10 -0.83 0.92 0.99 -0.87 -3.16 116.97 115.62 1xi9 h TYR 297 Ca 0.02 -0.25 -0.00 0.00 2.00 0.00 0.00 58.73 60.50 1xi9 h TYR 297 Cb 1.02 -0.26 -0.04 0.00 1.00 0.00 0.00 36.73 38.44 1xi9 h TYR 297 CO 0.08 1.06 0.51 0.52 -0.00 0.00 0.00 178.16 180.33 1xi9 h MET 298 N 0.83 1.12 0.29 4.88 2.86 -0.70 -0.74 114.93 123.47 1xi9 h MET 298 Ca 0.12 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1xi9 h MET 298 Cb 0.73 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 32.12 1xi9 h MET 298 CO 0.06 0.78 -0.38 -0.22 1.06 0.00 0.00 176.91 178.21 1xi9 h LYS 299 N 1.14 -0.69 -0.58 1.72 3.64 -1.43 0.15 116.57 120.52 1xi9 h LYS 299 Ca 0.30 0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.65 1xi9 h LYS 299 Cb -0.06 0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 1xi9 h LYS 299 CO -0.06 -0.46 0.05 0.87 -2.27 0.00 0.00 179.45 177.58 1xi9 h LYS 300 N -0.72 0.97 -0.75 1.90 6.56 -1.53 -2.35 116.57 120.66 1xi9 h LYS 300 Ca -0.01 -0.27 -0.05 0.00 -1.06 0.00 0.00 60.65 59.26 1xi9 h LYS 300 Cb 0.67 -0.11 -0.03 0.00 -0.57 0.00 0.00 32.23 32.19 1xi9 h LYS 300 CO -0.12 0.93 0.26 -0.07 -2.06 0.00 0.00 179.45 178.39 1xi9 h LEU 301 N 0.91 1.07 -0.53 2.94 3.38 -0.87 -1.34 115.31 120.86 1xi9 h LEU 301 Ca 0.18 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1xi9 h LEU 301 Cb 0.46 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1xi9 h LEU 301 CO 0.02 0.98 0.35 0.50 0.09 0.00 0.00 178.44 180.37 1xi9 h LYS 302 N 1.10 0.70 -0.98 1.13 3.64 -0.54 -0.30 116.57 121.32 1xi9 h LYS 302 Ca 0.25 -0.04 0.11 0.00 -1.27 0.00 0.00 60.65 59.69 1xi9 h LYS 302 Cb 0.27 -0.16 -0.08 0.00 -0.41 0.00 0.00 32.23 31.85 1xi9 h LYS 302 CO -0.01 0.47 0.62 0.93 -2.27 0.00 0.00 179.45 179.19 1xi9 h GLU 303 N 0.72 0.96 0.01 1.90 5.08 -1.10 -0.87 114.58 121.28 1xi9 h GLU 303 Ca 0.19 -0.06 -0.22 0.00 -1.00 0.00 0.00 59.36 58.27 1xi9 h GLU 303 Cb -0.08 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 28.95 1xi9 h GLU 303 CO -0.04 0.64 -0.94 0.00 -1.00 0.00 0.00 179.01 177.66 1xi9 h ARG 304 N 0.99 0.37 0.57 2.33 3.08 -0.83 -1.41 114.38 119.49 1xi9 h ARG 304 Ca 0.47 -0.40 -0.03 0.00 0.07 0.00 0.00 59.98 60.09 1xi9 h ARG 304 Cb 0.44 0.12 0.01 0.00 0.08 0.00 0.00 29.97 30.61 1xi9 h ARG 304 CO -0.23 1.08 -0.27 -0.09 -1.07 0.00 0.00 179.97 179.39 1xi9 h ARG 305 N 0.20 -0.74 -0.59 0.04 1.12 -0.78 -1.37 114.38 112.26 1xi9 h ARG 305 Ca -0.08 0.05 0.09 0.00 -1.11 0.00 0.00 59.98 58.93 1xi9 h ARG 305 Cb 1.58 0.17 -0.07 0.00 -0.01 0.00 0.00 29.97 31.64 1xi9 h ARG 305 CO 0.16 -0.46 0.23 -0.44 -3.11 0.00 0.00 179.97 176.35 1xi9 h ASP 306 N -0.84 0.24 0.60 -3.80 3.32 -1.17 -1.36 116.42 113.41 1xi9 h ASP 306 Ca -0.08 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 1xi9 h ASP 306 Cb 0.62 0.04 0.01 0.00 0.22 0.00 0.00 39.33 40.22 1xi9 h ASP 306 CO 0.13 0.15 -0.29 0.22 -1.72 0.00 0.00 179.24 177.73 1xi9 h TYR 307 N 0.42 -0.75 -0.33 4.55 5.03 -1.20 -1.60 116.97 123.09 1xi9 h TYR 307 Ca 0.29 -0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.55 1xi9 h TYR 307 Cb 0.34 0.25 -0.02 0.00 1.55 0.00 0.00 36.73 38.85 1xi9 h TYR 307 CO -0.16 -0.42 0.06 0.97 -1.32 0.00 0.00 178.16 177.29 1xi9 h ILE 308 N -0.95 1.17 -0.17 1.81 2.10 -1.16 -0.66 117.51 119.65 1xi9 h ILE 308 Ca -0.08 -0.61 -0.01 0.00 1.08 0.00 0.00 64.86 65.24 1xi9 h ILE 308 Cb 0.66 0.85 -0.01 0.00 -1.09 0.00 0.00 36.82 37.24 1xi9 h ILE 308 CO 0.14 0.22 0.07 0.22 -1.08 0.00 0.00 178.15 177.71 1xi9 h TYR 309 N 0.48 0.27 -0.46 2.19 5.03 -1.23 -0.72 116.97 122.53 1xi9 h TYR 309 Ca 0.11 -0.02 0.01 0.00 2.58 0.00 0.00 58.73 61.41 1xi9 h TYR 309 Cb 0.22 -0.08 -0.03 0.00 1.55 0.00 0.00 36.73 38.40 1xi9 h TYR 309 CO 0.01 0.34 0.29 -0.22 -1.32 0.00 0.00 178.16 177.26 1xi9 h LYS 310 N 0.12 0.58 -0.26 1.82 3.64 -0.96 -2.14 116.57 119.36 1xi9 h LYS 310 Ca 0.06 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.35 1xi9 h LYS 310 Cb 0.19 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1xi9 h LYS 310 CO -0.00 0.38 -0.02 0.00 -2.27 0.00 0.00 179.45 177.54 1xi9 h ARG 311 N 0.59 0.48 -0.48 1.90 2.47 -1.01 -2.99 114.38 115.34 1xi9 h ARG 311 Ca 0.17 -0.16 -0.05 0.00 -1.26 0.00 0.00 59.98 58.67 1xi9 h ARG 311 Cb -0.04 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.22 1xi9 h ARG 311 CO -0.05 0.66 0.07 -0.07 0.56 0.00 0.00 179.97 181.14 1xi9 h LEU 312 N 0.25 0.70 -0.53 3.04 3.38 -1.06 -3.04 115.31 118.05 1xi9 h LEU 312 Ca 0.07 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1xi9 h LEU 312 Cb 0.46 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 1xi9 h LEU 312 CO 0.02 0.72 -0.10 0.78 0.09 0.00 0.00 178.44 179.95 1xi9 h ASN 313 N 0.71 0.00 -0.12 -0.43 2.35 -1.40 -2.97 115.58 113.72 1xi9 h ASN 313 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1xi9 h ASN 313 Cb 0.33 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.70 1xi9 h ASN 313 CO 0.01 0.10 0.00 -1.84 -1.65 0.00 0.00 177.43 174.05 1xi9 n GLU 314 N -3.16 1.69 -3.29 0.81 0.28 -1.13 -4.73 120.64 111.10 1xi9 n GLU 314 Ca 0.02 -1.03 -0.41 0.00 -0.16 0.00 0.00 57.16 55.59 1xi9 n GLU 314 Cb 0.49 -1.42 -0.08 0.00 1.43 0.00 0.00 31.44 31.86 1xi9 n GLU 314 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1xi9 s ILE 315 N -1.85 5.07 0.30 3.84 1.01 -1.12 -5.06 121.20 123.39 1xi9 s ILE 315 Ca 0.34 0.28 -0.30 0.00 0.00 0.00 0.00 60.65 60.98 1xi9 s ILE 315 Cb 0.18 -3.91 -0.11 0.00 0.01 0.00 0.00 42.46 38.64 1xi9 s ILE 315 CO 0.28 -0.15 1.55 -2.84 0.00 0.00 0.00 174.94 173.78 1xi9 s PRO 316 N 2.27 4.14 0.00 2.79 0.02 -1.26 -2.34 135.00 140.62 1xi9 s PRO 316 Ca 0.17 2.54 0.00 0.00 0.02 0.00 0.00 61.00 63.72 1xi9 s PRO 316 Cb -0.16 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.34 1xi9 s PRO 316 CO 0.12 -0.58 0.00 0.41 -0.33 0.00 0.00 177.00 176.62 1xi9 n GLY 317 N 1.82 0.75 2.96 0.52 0.00 -1.26 -4.91 105.19 105.08 1xi9 n GLY 317 Ca 0.06 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.90 1xi9 n GLY 317 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xi9 s ILE 318 N -2.97 0.59 0.07 -0.61 -1.09 -0.99 -1.39 121.20 114.80 1xi9 s ILE 318 Ca 0.00 -0.25 0.01 0.00 -2.23 0.00 0.00 60.65 58.18 1xi9 s ILE 318 Cb 0.00 -0.54 -0.04 0.00 -1.58 0.00 0.00 42.46 40.30 1xi9 s ILE 318 CO 0.00 0.20 -0.06 -0.94 -1.23 0.00 0.00 174.94 172.91 1xi9 s SER 319 N 0.25 0.82 -0.01 3.58 1.04 -1.05 -4.63 113.70 113.70 1xi9 s SER 319 Ca -0.03 -0.85 -0.29 0.00 0.48 0.00 0.00 55.95 55.26 1xi9 s SER 319 Cb -0.08 0.11 0.07 0.00 0.10 0.00 0.00 66.02 66.22 1xi9 s SER 319 CO 0.00 -0.42 0.64 0.28 0.98 0.00 0.00 173.24 174.72 1xi9 s THR 320 N -2.97 0.00 0.87 2.02 -1.32 -1.26 -0.13 115.64 112.85 1xi9 s THR 320 Ca 0.03 -0.03 -0.11 0.00 -1.21 0.00 0.00 61.69 60.36 1xi9 s THR 320 Cb 0.01 -0.99 0.11 0.00 -1.51 0.00 0.00 72.50 70.13 1xi9 s THR 320 CO -0.05 -0.02 1.09 0.42 -2.21 0.00 0.00 174.62 173.86 1xi9 s THR 321 N -1.70 2.78 -0.35 5.08 -4.23 -1.26 -4.98 115.64 110.98 1xi9 s THR 321 Ca -0.09 0.25 -0.19 0.00 -1.18 0.00 0.00 61.69 60.49 1xi9 s THR 321 Cb -0.00 -2.78 -0.00 0.00 1.34 0.00 0.00 72.50 71.05 1xi9 s THR 321 CO 0.05 -0.33 0.56 -0.75 -0.54 0.00 0.00 174.62 173.61 1xi9 s LYS 322 N -4.97 3.67 0.28 3.99 2.20 -1.26 -4.81 119.74 118.83 1xi9 s LYS 322 Ca 0.63 -0.06 -0.30 0.00 -0.36 0.00 0.00 55.97 55.88 1xi9 s LYS 322 Cb -0.17 -3.80 -0.11 0.00 -1.51 0.00 0.00 37.83 32.24 1xi9 s LYS 322 CO 0.56 -0.66 1.52 -2.14 -0.36 0.00 0.00 175.35 174.27 1xi9 s PRO 323 N 2.50 4.19 -0.01 4.03 0.02 -1.26 -4.92 135.00 139.54 1xi9 s PRO 323 Ca 0.21 2.45 0.22 0.00 0.02 0.00 0.00 61.00 63.90 1xi9 s PRO 323 Cb -0.15 -3.06 -0.27 0.00 0.02 0.00 0.00 34.50 31.04 1xi9 s PRO 323 CO 0.14 -0.53 0.69 1.04 -0.33 0.00 0.00 177.00 178.00 1xi9 n GLN 324 N 2.10 0.37 -4.05 5.54 6.02 0.93 -4.89 117.38 123.40 1xi9 n GLN 324 Ca 0.07 -0.10 -0.13 0.00 -0.01 0.00 0.00 57.00 56.83 1xi9 n GLN 324 Cb 0.39 -1.52 -0.04 0.00 1.02 0.00 0.00 30.24 30.09 1xi9 n GLN 324 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1xi9 s GLY 325 N -3.84 1.16 0.00 1.08 0.00 -0.41 -1.54 107.32 103.76 1xi9 s GLY 325 Ca -0.01 -1.30 0.00 0.00 0.00 0.00 0.00 44.72 43.41 1xi9 s GLY 325 CO 0.89 -0.87 0.00 0.00 0.00 0.00 0.00 173.10 173.12 1xi9 n ALA 326 N -0.50 0.00 -2.46 3.20 0.00 -0.55 -4.45 120.51 115.74 1xi9 n ALA 326 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 1xi9 n ALA 326 Cb 0.62 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.12 1xi9 n ALA 326 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1xi9 n PHE 327 N 0.00 1.08 -4.37 0.00 1.16 -1.26 -4.94 117.46 109.13 1xi9 n PHE 327 Ca 0.00 -1.66 -0.28 0.00 -1.87 0.00 0.00 57.45 53.63 1xi9 n PHE 327 Cb 0.00 -0.23 -0.12 0.00 -1.61 0.00 0.00 39.48 37.52 1xi9 n PHE 327 CO 0.00 0.00 0.00 0.71 -1.87 0.00 0.00 176.76 175.60 1xi9 s TYR 328 N -2.73 2.38 0.05 2.97 2.02 -1.26 -1.96 117.35 118.81 1xi9 s TYR 328 Ca 0.35 -0.34 0.06 0.00 -0.37 0.00 0.00 57.07 56.76 1xi9 s TYR 328 Cb 0.36 -1.24 -0.02 0.00 -0.40 0.00 0.00 41.96 40.66 1xi9 s TYR 328 CO -0.06 0.41 -0.16 -1.50 -1.57 0.00 0.00 175.55 172.67 1xi9 s ILE 329 N -1.31 1.27 -0.51 2.71 2.07 -0.04 -4.35 121.20 121.03 1xi9 s ILE 329 Ca 0.18 -1.10 0.07 0.00 -1.41 0.00 0.00 60.65 58.39 1xi9 s ILE 329 Cb -0.09 -1.14 0.28 0.00 0.13 0.00 0.00 42.46 41.63 1xi9 s ILE 329 CO 0.09 0.02 0.70 0.33 -1.91 0.00 0.00 174.94 174.17 1xi9 n PHE 330 N 1.78 1.94 -1.50 3.50 7.35 -1.26 -1.28 117.46 127.99 1xi9 n PHE 330 Ca -0.18 -3.89 -0.33 0.00 -0.76 0.00 0.00 57.45 52.28 1xi9 n PHE 330 Cb 0.54 -0.46 0.08 0.00 0.35 0.00 0.00 39.48 39.99 1xi9 n PHE 330 CO 0.00 0.00 0.00 -2.14 -0.76 0.00 0.00 176.76 173.86 1xi9 s PRO 331 N -2.19 2.32 -0.12 -7.13 0.02 -1.03 -4.67 135.00 122.21 1xi9 s PRO 331 Ca 0.40 1.58 -0.12 0.00 0.02 0.00 0.00 61.00 62.88 1xi9 s PRO 331 Cb 0.20 -1.87 -0.05 0.00 0.02 0.00 0.00 34.50 32.80 1xi9 s PRO 331 CO -0.07 -1.65 0.26 0.21 -0.33 0.00 0.00 177.00 175.41 1xi9 s LYS 332 N -4.06 3.96 -0.87 5.54 2.20 0.82 -1.44 119.74 125.89 1xi9 s LYS 332 Ca 0.70 0.07 -0.19 0.00 -0.36 0.00 0.00 55.97 56.19 1xi9 s LYS 332 Cb -0.25 -3.32 0.13 0.00 -1.51 0.00 0.00 37.83 32.88 1xi9 s LYS 332 CO 0.45 0.49 1.07 0.42 -0.36 0.00 0.00 175.35 177.41 1xi9 s ILE 333 N -0.27 4.72 0.23 5.43 1.01 -0.39 -2.52 121.20 129.41 1xi9 s ILE 333 Ca 0.17 -1.43 -0.08 0.00 0.00 0.00 0.00 60.65 59.31 1xi9 s ILE 333 Cb -0.13 -4.74 0.19 0.00 0.01 0.00 0.00 42.46 37.80 1xi9 s ILE 333 CO 0.05 -1.46 1.86 -0.33 0.00 0.00 0.00 174.94 175.06 1xi9 h GLU 334 N 8.90 1.19 -3.10 2.79 5.08 -1.52 -3.46 114.58 124.46 1xi9 h GLU 334 Ca 0.07 -0.12 -0.13 0.00 -1.00 0.00 0.00 59.36 58.18 1xi9 h GLU 334 Cb 1.03 -0.24 -0.21 0.00 0.50 0.00 0.00 28.75 29.84 1xi9 h GLU 334 CO 1.10 0.86 -0.32 0.14 -1.00 0.00 0.00 179.01 179.79 1xi9 s VAL 335 N -5.90 0.05 0.00 3.13 -7.23 -1.23 -5.06 120.40 104.16 1xi9 s VAL 335 Ca -0.13 -0.45 0.00 0.00 -1.81 0.00 0.00 61.98 59.59 1xi9 s VAL 335 Cb 0.16 -0.56 0.00 0.00 0.56 0.00 0.00 36.38 36.54 1xi9 s VAL 335 CO 0.82 -0.25 0.00 0.61 -0.31 0.00 0.00 175.10 175.97 1xi9 n GLY 336 N 1.51 2.71 0.29 2.32 0.00 -1.26 -4.92 105.19 105.84 1xi9 n GLY 336 Ca -0.21 -1.12 0.17 0.00 0.00 0.00 0.00 46.02 44.87 1xi9 n GLY 336 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xi9 h PRO 337 N 0.00 0.00 -6.88 1.61 0.13 -2.02 -3.46 132.00 121.38 1xi9 h PRO 337 Ca 0.00 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.60 1xi9 h PRO 337 Cb 0.00 0.00 0.08 0.00 0.13 0.00 0.00 31.00 31.21 1xi9 h PRO 337 CO 0.00 0.04 0.72 -1.58 -0.23 0.00 0.00 178.00 176.95 1xi9 s TRP 338 N -3.86 2.85 0.22 1.56 0.51 -1.26 -4.95 118.94 114.02 1xi9 s TRP 338 Ca -0.01 1.23 -0.01 0.00 -2.12 0.00 0.00 56.10 55.19 1xi9 s TRP 338 Cb 0.11 -3.85 0.22 0.00 -0.81 0.00 0.00 33.47 29.13 1xi9 s TRP 338 CO 0.53 -2.50 1.58 0.87 -0.51 0.00 0.00 176.95 176.92 1xi9 h LYS 339 N 3.56 0.51 -3.54 4.98 6.56 -1.97 -3.47 116.57 123.19 1xi9 h LYS 339 Ca -0.49 -0.27 -0.06 0.00 -1.06 0.00 0.00 60.65 58.76 1xi9 h LYS 339 Cb 1.23 0.01 -0.07 0.00 -0.57 0.00 0.00 32.23 32.83 1xi9 h LYS 339 CO 0.68 0.86 -0.03 0.54 -2.06 0.00 0.00 179.45 179.43 1xi9 s ASN 340 N -6.87 0.04 0.49 0.86 2.20 -1.26 -5.06 114.94 105.34 1xi9 s ASN 340 Ca -0.07 -0.99 0.28 0.00 -0.94 0.00 0.00 52.86 51.15 1xi9 s ASN 340 Cb 0.12 0.65 0.95 0.00 -2.00 0.00 0.00 41.25 40.97 1xi9 s ASN 340 CO 0.82 -1.26 1.83 -2.24 -2.94 0.00 0.00 177.10 173.31 1xi9 h ASP 341 N 2.16 0.00 0.11 3.54 3.04 -1.91 -2.84 116.42 120.51 1xi9 h ASP 341 Ca -0.26 0.00 -0.01 0.00 -3.24 0.00 0.00 57.03 53.53 1xi9 h ASP 341 Cb 1.25 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.54 1xi9 h ASP 341 CO 0.34 0.05 -0.05 0.50 -2.04 0.00 0.00 179.24 178.04 1xi9 h LYS 342 N 0.00 -0.14 -0.95 4.15 1.63 -1.93 -2.21 116.57 117.11 1xi9 h LYS 342 Ca -0.00 0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.81 1xi9 h LYS 342 Cb 0.72 0.03 -0.05 0.00 -0.60 0.00 0.00 32.23 32.34 1xi9 h LYS 342 CO 0.01 0.10 0.58 1.49 -3.45 0.00 0.00 179.45 178.18 1xi9 h GLU 343 N -0.37 1.29 -0.35 1.90 4.81 -1.97 -2.51 114.58 117.38 1xi9 h GLU 343 Ca -0.01 -0.11 0.04 0.00 -0.13 0.00 0.00 59.36 59.14 1xi9 h GLU 343 Cb 0.30 -0.27 -0.04 0.00 0.63 0.00 0.00 28.75 29.37 1xi9 h GLU 343 CO 0.02 0.89 0.14 0.35 -0.73 0.00 0.00 179.01 179.69 1xi9 h PHE 344 N 1.31 0.25 -0.33 0.92 3.04 -1.46 -1.36 116.94 119.33 1xi9 h PHE 344 Ca 0.34 0.02 -0.11 0.00 3.98 0.00 0.00 57.97 62.20 1xi9 h PHE 344 Cb -0.07 -0.06 -0.01 0.00 2.56 0.00 0.00 35.95 38.36 1xi9 h PHE 344 CO 0.00 0.12 -0.25 0.28 -2.02 0.00 0.00 178.31 176.44 1xi9 h VAL 345 N 0.30 1.27 -0.16 1.41 2.07 -1.18 -1.55 116.25 118.41 1xi9 h VAL 345 Ca 0.16 -1.34 -0.11 0.00 0.82 0.00 0.00 66.70 66.22 1xi9 h VAL 345 Cb 0.11 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 1xi9 h VAL 345 CO -0.14 0.44 -0.38 -0.07 0.02 0.00 0.00 177.57 177.43 1xi9 h LEU 346 N 0.57 0.37 -0.24 2.57 3.38 -1.35 -1.16 115.31 119.45 1xi9 h LEU 346 Ca 0.08 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1xi9 h LEU 346 Cb 0.73 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1xi9 h LEU 346 CO 0.06 0.72 0.11 -0.78 0.09 0.00 0.00 178.44 178.64 1xi9 h ASP 347 N 0.30 0.32 -0.47 -0.43 3.58 -0.77 -1.93 116.42 117.03 1xi9 h ASP 347 Ca 0.03 -0.13 -0.09 0.00 0.42 0.00 0.00 57.03 57.26 1xi9 h ASP 347 Cb 0.81 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.76 1xi9 h ASP 347 CO 0.06 0.36 -0.05 0.58 -2.88 0.00 0.00 179.24 177.31 1xi9 h VAL 348 N 0.25 1.26 0.50 2.25 2.07 -1.19 -1.99 116.25 119.41 1xi9 h VAL 348 Ca 0.08 -1.15 -0.02 0.00 0.82 0.00 0.00 66.70 66.42 1xi9 h VAL 348 Cb 0.13 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 1xi9 h VAL 348 CO -0.01 0.41 -0.24 0.25 0.02 0.00 0.00 177.57 177.99 1xi9 h LEU 349 N 0.83 -0.57 -0.93 2.57 5.85 -1.13 0.10 115.31 122.03 1xi9 h LEU 349 Ca 0.15 -0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.76 1xi9 h LEU 349 Cb 0.57 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 1xi9 h LEU 349 CO 0.03 -0.35 -0.12 -0.74 -0.34 0.00 0.00 178.44 176.92 1xi9 h HIS 350 N -0.76 0.70 0.00 1.25 2.76 -1.31 -1.72 115.15 116.08 1xi9 h HIS 350 Ca -0.07 -0.12 -0.15 0.00 -2.20 0.00 0.00 60.37 57.83 1xi9 h HIS 350 Cb 0.56 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 29.31 1xi9 h HIS 350 CO -0.02 0.74 -1.81 0.09 -1.30 0.00 0.00 177.93 175.63 1xi9 n ASN 351 N -4.17 1.76 -0.11 3.26 3.02 -0.75 -4.54 115.26 113.72 1xi9 n ASN 351 Ca 0.01 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.61 1xi9 n ASN 351 Cb 0.35 1.13 -0.04 0.00 -0.61 0.00 0.00 39.78 40.61 1xi9 n ASN 351 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xi9 n ALA 352 N -2.30 3.24 -3.90 5.41 0.00 0.28 -5.01 120.51 118.23 1xi9 n ALA 352 Ca -0.14 -0.38 -0.29 0.00 0.00 0.00 0.00 53.44 52.63 1xi9 n ALA 352 Cb 0.72 -0.41 0.02 0.00 0.00 0.00 0.00 19.45 19.78 1xi9 n ALA 352 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1xi9 n HIS 353 N -0.83 -2.13 -4.62 0.00 8.25 -0.65 -4.88 115.22 110.36 1xi9 n HIS 353 Ca 0.03 0.87 -0.24 0.00 -0.26 0.00 0.00 57.72 58.13 1xi9 n HIS 353 Cb 0.21 -3.96 -0.16 0.00 1.12 0.00 0.00 29.99 27.20 1xi9 n HIS 353 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1xi9 s VAL 354 N -3.42 1.15 -0.26 1.59 1.01 -1.20 -1.37 120.40 117.89 1xi9 s VAL 354 Ca 0.49 -0.53 -0.04 0.00 0.00 0.00 0.00 61.98 61.90 1xi9 s VAL 354 Cb -0.25 -1.02 0.01 0.00 0.00 0.00 0.00 36.38 35.12 1xi9 s VAL 354 CO 0.84 0.35 0.00 -0.22 0.00 0.00 0.00 175.10 176.07 1xi9 s LEU 355 N 0.32 3.41 0.00 3.92 2.96 0.31 -3.09 118.68 126.51 1xi9 s LEU 355 Ca -0.08 -0.69 0.04 0.00 -0.22 0.00 0.00 54.13 53.18 1xi9 s LEU 355 Cb -0.12 -1.77 0.04 0.00 0.50 0.00 0.00 46.19 44.83 1xi9 s LEU 355 CO 0.02 -0.13 0.34 0.49 -1.32 0.00 0.00 176.35 175.75 1xi9 n PHE 356 N 4.78 -1.81 -4.83 5.38 0.99 -1.26 -1.13 117.46 119.58 1xi9 n PHE 356 Ca -0.16 -1.23 -0.33 0.00 -0.00 0.00 0.00 57.45 55.73 1xi9 n PHE 356 Cb 0.48 -0.28 -0.14 0.00 -1.00 0.00 0.00 39.48 38.54 1xi9 n PHE 356 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 1xi9 s VAL 357 N -1.25 2.99 0.11 -4.37 1.01 -0.87 -4.71 120.40 113.32 1xi9 s VAL 357 Ca 0.26 -0.70 -0.31 0.00 0.00 0.00 0.00 61.98 61.23 1xi9 s VAL 357 Cb -0.02 -2.23 -0.09 0.00 0.00 0.00 0.00 36.38 34.03 1xi9 s VAL 357 CO 0.16 0.54 1.62 -1.38 0.00 0.00 0.00 175.10 176.04 1xi9 s HIS 358 N 0.16 2.70 0.34 5.22 -3.43 -1.26 -0.49 115.29 118.52 1xi9 s HIS 358 Ca -0.07 0.45 0.11 0.00 -0.80 0.00 0.00 55.06 54.75 1xi9 s HIS 358 Cb -0.15 -3.95 0.93 0.00 -1.43 0.00 0.00 32.58 27.97 1xi9 s HIS 358 CO 0.05 -3.69 1.74 0.78 -2.00 0.00 0.00 174.74 171.62 1xi9 h GLY 359 N 7.78 1.74 2.00 -1.38 0.00 -0.50 -0.89 103.07 111.81 1xi9 h GLY 359 Ca -0.43 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 46.61 1xi9 h GLY 359 CO 0.92 -0.21 0.00 -1.14 0.00 0.00 0.00 176.54 176.12 1xi9 n SER 360 N -4.81 0.14 0.00 0.19 3.41 -1.20 -0.74 113.62 110.60 1xi9 n SER 360 Ca 0.26 0.54 0.10 0.00 -0.26 0.00 0.00 58.87 59.51 1xi9 n SER 360 Cb 0.77 -0.57 0.52 0.00 -0.26 0.00 0.00 64.21 64.67 1xi9 n SER 360 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xi9 n GLY 361 N -0.20 -0.91 1.75 5.00 0.00 -0.34 -2.55 105.19 107.94 1xi9 n GLY 361 Ca 0.03 -0.10 -0.19 0.00 0.00 0.00 0.00 46.02 45.76 1xi9 n GLY 361 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1xi9 n PHE 362 N -1.25 2.20 -0.66 1.61 3.01 0.08 -4.74 117.46 117.70 1xi9 n PHE 362 Ca 0.10 -2.14 0.04 0.00 1.01 0.00 0.00 57.45 56.46 1xi9 n PHE 362 Cb 0.15 -0.70 -0.01 0.00 -0.01 0.00 0.00 39.48 38.92 1xi9 n PHE 362 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1xi9 n GLY 363 N -0.96 -2.17 0.36 1.37 0.00 -1.06 -0.94 105.19 101.80 1xi9 n GLY 363 Ca 0.45 -1.45 0.11 0.00 0.00 0.00 0.00 46.02 45.13 1xi9 n GLY 363 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1xi9 h GLU 364 N 0.00 0.60 0.00 1.61 9.09 -1.92 -0.41 114.58 123.55 1xi9 h GLU 364 Ca 0.01 -0.04 0.00 0.00 0.05 0.00 0.00 59.36 59.38 1xi9 h GLU 364 Cb 0.24 -0.13 0.00 0.00 -1.65 0.00 0.00 28.75 27.20 1xi9 h GLU 364 CO 0.00 0.39 0.00 0.66 0.05 0.00 0.00 179.01 180.12 1xi9 n TYR 365 N -4.50 0.22 0.31 2.06 4.02 -1.26 -2.74 117.16 115.26 1xi9 n TYR 365 Ca 0.13 0.07 0.12 0.00 -0.01 0.00 0.00 57.90 58.22 1xi9 n TYR 365 Cb 0.39 -0.62 0.10 0.00 -0.02 0.00 0.00 39.34 39.19 1xi9 n TYR 365 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1xi9 h GLY 366 N 3.80 0.00 -3.87 2.72 0.00 -1.20 -3.41 103.07 101.11 1xi9 h GLY 366 Ca 0.00 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.73 1xi9 h GLY 366 CO 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 176.54 176.46 1xi9 n ALA 367 N -2.03 -0.60 -1.25 3.60 0.00 -1.11 -1.98 120.51 117.13 1xi9 n ALA 367 Ca 0.02 0.21 -0.09 0.00 0.00 0.00 0.00 53.44 53.58 1xi9 n ALA 367 Cb 0.50 -1.94 -0.04 0.00 0.00 0.00 0.00 19.45 17.97 1xi9 n ALA 367 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xi9 n GLY 368 N 1.45 1.03 3.48 0.00 0.00 -1.26 -4.87 105.19 105.02 1xi9 n GLY 368 Ca 0.11 -0.42 -0.23 0.00 0.00 0.00 0.00 46.02 45.48 1xi9 n GLY 368 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1xi9 s HIS 369 N -2.22 1.92 0.07 1.61 4.02 -0.84 -1.26 115.29 118.60 1xi9 s HIS 369 Ca 0.00 -1.03 -0.01 0.00 1.02 0.00 0.00 55.06 55.03 1xi9 s HIS 369 Cb 0.00 -1.27 -0.04 0.00 -1.02 0.00 0.00 32.58 30.25 1xi9 s HIS 369 CO 0.00 -0.05 -0.00 -0.59 1.02 0.00 0.00 174.74 175.11 1xi9 s PHE 370 N -3.26 0.58 -0.14 1.40 -0.71 -0.52 0.11 117.98 115.45 1xi9 s PHE 370 Ca 0.32 -1.09 -0.00 0.00 -1.04 0.00 0.00 56.93 55.12 1xi9 s PHE 370 Cb 0.07 -0.40 -0.01 0.00 -1.21 0.00 0.00 43.02 41.47 1xi9 s PHE 370 CO 0.15 -0.42 -0.13 0.50 -1.34 0.00 0.00 175.22 173.98 1xi9 s ARG 371 N -3.95 3.34 0.06 1.99 3.52 0.35 -2.46 118.95 121.82 1xi9 s ARG 371 Ca 0.11 -0.70 0.09 0.00 -0.13 0.00 0.00 55.73 55.10 1xi9 s ARG 371 Cb 0.08 -2.65 -0.03 0.00 -1.56 0.00 0.00 34.95 30.78 1xi9 s ARG 371 CO -0.07 0.14 -0.25 0.00 -0.81 0.00 0.00 175.30 174.31 1xi9 s ALA 372 N 0.54 2.11 -0.05 6.12 0.00 -0.41 -2.05 121.76 128.02 1xi9 s ALA 372 Ca -0.09 -1.25 -0.10 0.00 0.00 0.00 0.00 51.96 50.53 1xi9 s ALA 372 Cb -0.16 -0.41 -0.05 0.00 0.00 0.00 0.00 23.12 22.51 1xi9 s ALA 372 CO 0.04 0.48 0.26 0.08 0.00 0.00 0.00 175.76 176.63 1xi9 s VAL 373 N -0.87 5.29 -0.39 0.00 1.01 -0.22 -0.86 120.40 124.36 1xi9 s VAL 373 Ca 0.11 0.45 0.06 0.00 0.00 0.00 0.00 61.98 62.59 1xi9 s VAL 373 Cb -0.10 -3.55 0.57 0.00 0.00 0.00 0.00 36.38 33.30 1xi9 s VAL 373 CO 0.03 0.56 1.69 2.22 0.00 0.00 0.00 175.10 179.60 1xi9 n PHE 374 N 1.77 2.16 0.08 5.22 1.16 -0.83 -4.68 117.46 122.34 1xi9 n PHE 374 Ca -0.16 -1.87 -0.03 0.00 -1.87 0.00 0.00 57.45 53.52 1xi9 n PHE 374 Cb 0.54 -0.76 0.19 0.00 -1.61 0.00 0.00 39.48 37.83 1xi9 n PHE 374 CO 0.00 0.00 0.00 -0.07 -1.87 0.00 0.00 176.76 174.82 1xi9 h LEU 375 N 1.15 0.28-10.19 5.98 3.38 -1.95 -3.44 115.31 110.52 1xi9 h LEU 375 Ca 0.43 -0.13 -0.51 0.00 0.09 0.00 0.00 57.88 57.77 1xi9 h LEU 375 Cb 2.07 -0.08 0.10 0.00 0.09 0.00 0.00 40.66 42.84 1xi9 h LEU 375 CO 0.81 0.71 0.38 -2.84 0.09 0.00 0.00 178.44 177.59 1xi9 s PRO 376 N -4.05 2.84 0.81 1.13 0.02 -1.26 -4.68 135.00 129.79 1xi9 s PRO 376 Ca -0.05 1.43 -0.14 0.00 0.02 0.00 0.00 61.00 62.27 1xi9 s PRO 376 Cb 0.13 -1.95 0.06 0.00 0.02 0.00 0.00 34.50 32.75 1xi9 s PRO 376 CO 0.78 -1.23 1.00 -2.30 -0.33 0.00 0.00 177.00 174.92 1xi9 n PRO 377 N -2.31 0.16 -0.32 5.54 -0.02 -1.26 -4.67 135.00 132.13 1xi9 n PRO 377 Ca 0.11 0.12 0.16 0.00 -2.02 0.00 0.00 63.50 61.87 1xi9 n PRO 377 Cb 0.52 -2.27 0.35 0.00 -0.02 0.00 0.00 33.50 32.08 1xi9 n PRO 377 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1xi9 h ILE 378 N -0.87 0.43 -0.80 4.25 1.08 -1.95 0.34 117.51 119.99 1xi9 h ILE 378 Ca -0.46 -0.13 0.08 0.00 -0.39 0.00 0.00 64.86 63.96 1xi9 h ILE 378 Cb 1.31 0.01 -0.07 0.00 -3.07 0.00 0.00 36.82 35.00 1xi9 h ILE 378 CO 0.44 0.07 0.46 -0.33 -0.69 0.00 0.00 178.15 178.11 1xi9 h GLU 379 N 0.39 0.79 -0.20 2.37 5.08 -1.99 0.47 114.58 121.49 1xi9 h GLU 379 Ca 0.61 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 58.78 1xi9 h GLU 379 Cb 1.21 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.28 1xi9 h GLU 379 CO -0.55 0.52 -0.40 0.82 -1.00 0.00 0.00 179.01 178.40 1xi9 h ILE 380 N 0.81 1.33 -0.67 3.13 2.04 -1.30 -2.63 117.51 120.22 1xi9 h ILE 380 Ca 0.37 -1.63 0.02 0.00 1.00 0.00 0.00 64.86 64.62 1xi9 h ILE 380 Cb 0.28 1.88 -0.04 0.00 -0.74 0.00 0.00 36.82 38.20 1xi9 h ILE 380 CO -0.22 0.51 0.43 -0.07 0.00 0.00 0.00 178.15 178.80 1xi9 h LEU 381 N 0.29 0.73 -0.37 1.44 3.38 -0.88 -0.90 115.31 119.00 1xi9 h LEU 381 Ca 0.01 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.00 1xi9 h LEU 381 Cb 1.00 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.55 1xi9 h LEU 381 CO 0.09 0.52 0.17 -0.08 0.09 0.00 0.00 178.44 179.22 1xi9 h GLU 382 N 0.87 0.33 -0.18 1.13 4.81 -0.09 0.54 114.58 121.98 1xi9 h GLU 382 Ca 0.26 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.46 1xi9 h GLU 382 Cb -0.05 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 1xi9 h GLU 382 CO -0.08 0.22 0.08 1.49 -0.73 0.00 0.00 179.01 180.00 1xi9 h GLU 383 N 0.34 0.27 -0.23 1.92 4.81 -1.22 -0.58 114.58 119.89 1xi9 h GLU 383 Ca 0.16 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.39 1xi9 h GLU 383 Cb 0.10 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.39 1xi9 h GLU 383 CO -0.13 0.32 -0.00 0.00 -0.73 0.00 0.00 179.01 178.47 1xi9 h ALA 384 N 0.93 0.20 -0.11 2.92 0.00 -0.82 -2.19 119.26 120.19 1xi9 h ALA 384 Ca 0.06 0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 1xi9 h ALA 384 Cb 0.15 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1xi9 h ALA 384 CO -0.01 -0.43 -0.45 0.52 0.00 0.00 0.00 179.25 178.89 1xi9 h MET 385 N 0.07 0.26 -0.14 0.00 2.86 0.16 -1.55 114.93 116.58 1xi9 h MET 385 Ca 0.11 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 1xi9 h MET 385 Cb 0.14 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 1xi9 h MET 385 CO -0.19 0.66 0.05 -0.44 1.06 0.00 0.00 176.91 178.06 1xi9 h ASP 386 N 0.21 0.20 -0.33 1.22 3.32 -0.91 0.15 116.42 120.28 1xi9 h ASP 386 Ca 0.01 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.88 1xi9 h ASP 386 Cb 0.88 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.36 1xi9 h ASP 386 CO 0.07 0.33 0.22 0.03 -1.72 0.00 0.00 179.24 178.17 1xi9 h ARG 387 N 0.06 0.44 -0.55 3.56 3.08 -1.34 -1.47 114.38 118.16 1xi9 h ARG 387 Ca 0.05 -0.03 -0.12 0.00 0.07 0.00 0.00 59.98 59.95 1xi9 h ARG 387 Cb 0.20 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 1xi9 h ARG 387 CO -0.00 0.29 -0.11 0.35 -1.07 0.00 0.00 179.97 179.42 1xi9 h PHE 388 N 0.45 1.17 -0.44 3.04 3.57 -1.19 0.05 116.94 123.60 1xi9 h PHE 388 Ca 0.12 -0.25 0.04 0.00 3.53 0.00 0.00 57.97 61.41 1xi9 h PHE 388 Cb -0.05 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 38.36 1xi9 h PHE 388 CO -0.05 1.08 0.21 1.49 -2.23 0.00 0.00 178.31 178.81 1xi9 h GLU 389 N 0.93 0.41 -0.53 1.11 4.81 -0.63 -1.51 114.58 119.17 1xi9 h GLU 389 Ca 0.14 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.36 1xi9 h GLU 389 Cb 0.69 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.95 1xi9 h GLU 389 CO 0.05 0.27 0.34 0.87 -0.73 0.00 0.00 179.01 179.82 1xi9 h LYS 390 N 0.42 0.68 -0.65 1.92 1.57 -0.99 -2.12 116.57 117.40 1xi9 h LYS 390 Ca 0.19 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.90 1xi9 h LYS 390 Cb 0.11 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 1xi9 h LYS 390 CO -0.14 0.45 0.27 0.35 -0.57 0.00 0.00 179.45 179.80 1xi9 h PHE 391 N 0.70 0.96 0.00 -1.35 3.57 -0.76 -2.73 116.94 117.33 1xi9 h PHE 391 Ca 0.20 -0.06 -0.24 0.00 3.53 0.00 0.00 57.97 61.41 1xi9 h PHE 391 Cb -0.06 -0.29 0.01 0.00 2.79 0.00 0.00 35.95 38.40 1xi9 h PHE 391 CO -0.04 0.73 -0.97 0.52 -2.23 0.00 0.00 178.31 176.32 1xi9 h MET 392 N 0.94 0.47 -0.70 1.11 2.86 -1.12 -2.83 114.93 115.65 1xi9 h MET 392 Ca 0.22 -0.51 -0.06 0.00 -2.06 0.00 0.00 59.70 57.29 1xi9 h MET 392 Cb 0.17 0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.95 1xi9 h MET 392 CO -0.02 1.16 0.20 -0.22 1.06 0.00 0.00 176.91 179.09 1xi9 h LYS 393 N 0.26 1.09 -0.28 1.72 3.64 -1.29 -3.06 116.57 118.66 1xi9 h LYS 393 Ca -0.09 -0.24 -0.08 0.00 -1.27 0.00 0.00 60.65 58.97 1xi9 h LYS 393 Cb 1.61 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 33.27 1xi9 h LYS 393 CO 0.17 0.94 -0.14 0.93 -2.27 0.00 0.00 179.45 179.09 1xi9 h GLU 394 N 1.05 0.58 0.00 1.90 5.08 -1.51 -3.52 114.58 118.17 1xi9 h GLU 394 Ca 0.23 -0.26 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1xi9 h GLU 394 Cb 0.32 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1xi9 h GLU 394 CO -0.00 0.83 0.00 0.54 -1.00 0.00 0.00 179.01 179.37