#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xi9 s ILE 2 N 0.00 4.86 0.02 -1.33 1.01 -1.26 -5.02 121.20 119.48 1xi9 s ILE 2 Ca 0.00 -0.45 -0.19 0.00 0.00 0.00 0.00 60.65 60.01 1xi9 s ILE 2 Cb 0.00 -4.30 -0.06 0.00 0.01 0.00 0.00 42.46 38.11 1xi9 s ILE 2 CO 0.00 -0.80 0.54 -0.13 0.00 0.00 0.00 174.94 174.55 1xi9 s ARG 3 N 2.66 4.20 0.70 2.79 1.81 -1.26 -5.08 118.95 124.77 1xi9 s ARG 3 Ca 0.16 0.66 -0.11 0.00 -1.72 0.00 0.00 55.73 54.71 1xi9 s ARG 3 Cb -0.19 -3.28 0.01 0.00 -0.45 0.00 0.00 34.95 31.04 1xi9 s ARG 3 CO 0.12 0.52 1.06 0.00 -0.68 0.00 0.00 175.30 176.33 1xi9 s ALA 4 N -0.67 2.65 0.06 2.13 0.00 -1.26 -4.99 121.76 119.68 1xi9 s ALA 4 Ca 0.28 0.08 -0.35 0.00 0.00 0.00 0.00 51.96 51.98 1xi9 s ALA 4 Cb -0.18 -3.18 -0.14 0.00 0.00 0.00 0.00 23.12 19.62 1xi9 s ALA 4 CO 0.17 -1.26 1.63 0.45 0.00 0.00 0.00 175.76 176.75 1xi9 n SER 5 N -3.16 2.91 -0.19 0.00 2.88 -1.26 -4.91 113.62 109.90 1xi9 n SER 5 Ca 0.08 1.06 -0.00 0.00 -1.33 0.00 0.00 58.87 58.67 1xi9 n SER 5 Cb 0.54 -1.36 0.09 0.00 -0.75 0.00 0.00 64.21 62.73 1xi9 n SER 5 CO 0.00 0.00 0.00 0.07 -1.23 0.00 0.00 175.04 173.88 1xi9 h LYS 6 N 6.61 0.17 0.00 -1.46 -0.00 -2.00 -1.88 116.57 118.01 1xi9 h LYS 6 Ca -0.46 -0.01 -0.02 0.00 -0.00 0.00 0.00 60.65 60.15 1xi9 h LYS 6 Cb 1.27 -0.04 -0.00 0.00 -0.00 0.00 0.00 32.23 33.46 1xi9 h LYS 6 CO 0.89 0.11 -0.11 0.07 -0.00 0.00 0.00 179.45 180.41 1xi9 h ARG 7 N 0.18 0.00 -0.04 0.07 0.11 -1.93 -2.81 114.38 109.96 1xi9 h ARG 7 Ca 0.29 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 60.18 1xi9 h ARG 7 Cb 0.45 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.54 1xi9 h ARG 7 CO -0.43 0.11 -0.74 0.00 0.10 0.00 0.00 179.97 179.01 1xi9 h ALA 8 N 1.89 0.15 0.00 0.08 0.00 -1.79 -3.24 119.26 116.34 1xi9 h ALA 8 Ca -0.00 -0.60 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 1xi9 h ALA 8 Cb 0.78 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1xi9 h ALA 8 CO 0.01 0.51 -0.03 -0.07 0.00 0.00 0.00 179.25 179.67 1xi9 h LEU 9 N 0.19 0.00 0.00 0.00 3.38 -1.19 -1.71 115.31 115.97 1xi9 h LEU 9 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1xi9 h LEU 9 Cb 1.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.16 1xi9 h LEU 9 CO 0.15 0.03 -0.27 -1.54 0.09 0.00 0.00 178.44 176.89 1xi9 n SER 10 N -3.41 0.31 -4.61 -0.43 3.41 -1.08 -4.81 113.62 103.01 1xi9 n SER 10 Ca -0.02 0.13 -0.43 0.00 -0.26 0.00 0.00 58.87 58.29 1xi9 n SER 10 Cb 0.14 -0.12 -0.02 0.00 -0.26 0.00 0.00 64.21 63.94 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 -3.01 3.79 0.25 -3.33 1.01 -0.65 -4.99 120.40 113.47 1xi9 s VAL 11 Ca 0.12 0.83 0.05 0.00 0.00 0.00 0.00 61.98 62.98 1xi9 s VAL 11 Cb 0.18 -3.99 -0.03 0.00 0.00 0.00 0.00 36.38 32.54 1xi9 s VAL 11 CO 0.62 -0.58 0.35 -1.61 0.00 0.00 0.00 175.10 173.89 1xi9 s GLU 12 N 5.00 3.35 0.00 2.72 0.41 -1.26 -5.07 118.70 123.84 1xi9 s GLU 12 Ca 0.67 -0.82 0.00 0.00 -0.41 0.00 0.00 54.97 54.41 1xi9 s GLU 12 Cb -0.18 -2.84 0.00 0.00 -1.78 0.00 0.00 34.13 29.33 1xi9 s GLU 12 CO 0.31 0.39 0.00 0.98 -0.49 0.00 0.00 175.26 176.45 1xi9 n TYR 13 N -1.41 0.00 0.00 1.61 9.36 -1.26 -4.76 117.16 120.71 1xi9 n TYR 13 Ca -0.08 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.14 1xi9 n TYR 13 Cb 0.57 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.28 1xi9 n TYR 13 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 1xi9 n PRO 21 N 0.00 0.00 0.07 2.98 -0.02 -1.26 -5.15 135.00 131.62 1xi9 n PRO 21 Ca 0.00 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.37 1xi9 n PRO 21 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 33.46 1xi9 n PRO 21 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xi9 h ALA 22 N 0.00 0.47 -0.33 3.55 0.00 -2.00 -3.08 119.26 117.87 1xi9 h ALA 22 Ca 0.00 -0.69 -0.03 0.00 0.00 0.00 0.00 54.91 54.18 1xi9 h ALA 22 Cb 0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1xi9 h ALA 22 CO 0.00 0.84 0.06 0.07 0.00 0.00 0.00 179.25 180.22 1xi9 h ARG 23 N 0.19 0.48 -0.34 0.00 0.11 -1.99 -2.08 114.38 110.76 1xi9 h ARG 23 Ca -0.06 -0.08 -0.12 0.00 0.10 0.00 0.00 59.98 59.82 1xi9 h ARG 23 Cb 1.50 -0.08 -0.01 0.00 1.11 0.00 0.00 29.97 32.48 1xi9 h ARG 23 CO 0.14 0.46 -0.29 0.93 0.10 0.00 0.00 179.97 181.31 1xi9 h GLU 24 N 0.47 0.71 -0.39 0.08 3.07 -1.99 -2.17 114.58 114.36 1xi9 h GLU 24 Ca 0.11 -0.32 -0.07 0.00 -0.50 0.00 0.00 59.36 58.58 1xi9 h GLU 24 Cb 0.21 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.09 1xi9 h GLU 24 CO -0.00 0.92 -0.04 -0.07 -1.40 0.00 0.00 179.01 178.42 1xi9 h LEU 25 N 0.61 0.71 -1.32 1.33 3.38 -1.38 -3.07 115.31 115.56 1xi9 h LEU 25 Ca 0.07 -0.33 -0.06 0.00 0.09 0.00 0.00 57.88 57.65 1xi9 h LEU 25 Cb 0.81 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1xi9 h LEU 25 CO 0.07 0.87 -0.20 -0.33 0.09 0.00 0.00 178.44 178.94 1xi9 h GLU 26 N 0.53 0.21 -0.77 1.13 5.08 -1.34 -1.51 114.58 117.91 1xi9 h GLU 26 Ca 0.11 -0.06 0.05 0.00 -1.00 0.00 0.00 59.36 58.46 1xi9 h GLU 26 Cb 0.53 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.70 1xi9 h GLU 26 CO 0.03 0.41 0.47 0.87 -1.00 0.00 0.00 179.01 179.79 1xi9 h LYS 27 N 0.19 0.85 0.00 2.33 1.57 -1.35 -1.51 116.57 118.66 1xi9 h LYS 27 Ca 0.04 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1xi9 h LYS 27 Cb 0.47 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1xi9 h LYS 27 CO 0.03 0.56 0.00 1.63 -0.57 0.00 0.00 179.45 181.10 1xi9 n LYS 28 N -4.67 0.88 -0.81 3.15 4.01 -0.84 -4.87 118.16 115.02 1xi9 n LYS 28 Ca 0.10 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.90 1xi9 n LYS 28 Cb 0.15 -1.23 0.00 0.00 -0.51 0.00 0.00 35.03 33.44 1xi9 n LYS 28 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1xi9 n GLY 29 N 0.56 0.83 3.67 0.72 0.00 -0.57 -5.03 105.19 105.38 1xi9 n GLY 29 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 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 -3.22 4.71 -0.07 -0.61 1.01 -0.63 -4.96 121.20 117.43 1xi9 s ILE 30 Ca 0.00 2.03 -0.26 0.00 0.00 0.00 0.00 60.65 62.43 1xi9 s ILE 30 Cb 0.00 -4.31 -0.03 0.00 0.01 0.00 0.00 42.46 38.13 1xi9 s ILE 30 CO 0.00 -0.12 0.82 -1.59 0.00 0.00 0.00 174.94 174.05 1xi9 s LYS 31 N 2.82 4.44 -0.08 2.79 0.00 -1.26 -3.15 119.74 125.30 1xi9 s LYS 31 Ca 0.45 1.08 0.03 0.00 0.00 0.00 0.00 55.97 57.54 1xi9 s LYS 31 Cb -0.16 -3.48 -0.02 0.00 0.00 0.00 0.00 37.83 34.17 1xi9 s LYS 31 CO 0.10 -0.07 -0.18 0.14 0.00 0.00 0.00 175.35 175.34 1xi9 s VAL 32 N 1.19 2.69 -0.24 1.79 -7.23 -1.26 -4.89 120.40 112.45 1xi9 s VAL 32 Ca 0.42 -0.83 -0.20 0.00 -1.81 0.00 0.00 61.98 59.56 1xi9 s VAL 32 Cb -0.18 -2.05 -0.02 0.00 0.56 0.00 0.00 36.38 34.68 1xi9 s VAL 32 CO 0.20 0.56 0.63 -0.63 -0.31 0.00 0.00 175.10 175.55 1xi9 s ILE 33 N -0.17 4.99 -0.49 -0.62 1.01 -0.08 -4.97 121.20 120.87 1xi9 s ILE 33 Ca -0.02 1.14 -0.19 0.00 0.00 0.00 0.00 60.65 61.59 1xi9 s ILE 33 Cb -0.14 -3.94 0.05 0.00 0.01 0.00 0.00 42.46 38.45 1xi9 s ILE 33 CO 0.03 0.05 0.61 -0.13 0.00 0.00 0.00 174.94 175.50 1xi9 s ARG 34 N 2.37 3.15 -0.15 2.79 0.52 -1.26 0.15 118.95 126.52 1xi9 s ARG 34 Ca 0.27 -0.78 0.16 0.00 -0.52 0.00 0.00 55.73 54.85 1xi9 s ARG 34 Cb -0.16 -4.06 0.58 0.00 0.52 0.00 0.00 34.95 31.84 1xi9 s ARG 34 CO 0.09 -1.15 1.49 1.28 0.02 0.00 0.00 175.30 177.03 1xi9 n LEU 35 N 6.13 4.22 -0.00 2.53 4.77 0.78 -4.63 117.00 130.80 1xi9 n LEU 35 Ca -0.06 -2.76 0.09 0.00 -0.03 0.00 0.00 56.01 53.26 1xi9 n LEU 35 Cb 0.46 -0.53 -0.11 0.00 -2.33 0.00 0.00 43.42 40.91 1xi9 n LEU 35 CO 0.53 0.70 -0.18 -0.46 -1.33 0.00 0.00 177.39 176.65 1xi9 n ASN 36 N 0.11 0.83 -4.41 -1.43 6.94 -0.93 -0.64 115.26 115.73 1xi9 n ASN 36 Ca 0.22 -0.76 -0.35 0.00 -0.02 0.00 0.00 54.58 53.67 1xi9 n ASN 36 Cb 0.88 1.17 -0.13 0.00 -2.36 0.00 0.00 39.78 39.34 1xi9 n ASN 36 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1xi9 s ILE 37 N -2.87 3.76 -0.14 1.53 1.01 -1.26 -4.84 121.20 118.38 1xi9 s ILE 37 Ca 0.04 -0.38 -0.02 0.00 0.00 0.00 0.00 60.65 60.29 1xi9 s ILE 37 Cb 0.14 -2.70 -0.01 0.00 0.01 0.00 0.00 42.46 39.90 1xi9 s ILE 37 CO 0.77 0.43 2.55 0.61 0.00 0.00 0.00 174.94 179.31 1xi9 n GLY 38 N 4.33 3.29 3.09 6.18 0.00 -1.26 -4.80 105.19 116.02 1xi9 n GLY 38 Ca -0.17 -0.86 -0.35 0.00 0.00 0.00 0.00 46.02 44.64 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 1.32 5.12 0.54 1.61 -1.08 -1.26 -4.98 116.67 117.95 1xi9 s ASP 39 Ca 0.34 -2.11 0.23 0.00 -0.52 0.00 0.00 52.55 50.50 1xi9 s ASP 39 Cb 0.20 -1.78 1.50 0.00 -1.46 0.00 0.00 42.92 41.39 1xi9 s ASP 39 CO -0.03 -0.49 2.16 1.55 0.52 0.00 0.00 175.17 178.88 1xi9 h PRO 40 N 7.88 0.00 0.00 4.34 0.13 -1.91 -2.18 132.00 140.26 1xi9 h PRO 40 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1xi9 h PRO 40 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1xi9 h PRO 40 CO 0.65 0.04 0.00 0.28 -0.23 0.00 0.00 178.00 178.75 1xi9 h VAL 41 N 0.00 0.00 0.00 1.56 2.07 -1.87 -0.92 116.25 117.08 1xi9 h VAL 41 Ca -0.00 -0.45 0.00 0.00 0.82 0.00 0.00 66.70 67.07 1xi9 h VAL 41 Cb 0.10 1.35 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1xi9 h VAL 41 CO 0.01 0.00 0.00 0.29 0.02 0.00 0.00 177.57 177.89 1xi9 n LYS 42 N -2.72 0.01 0.00 1.57 4.76 -0.82 -4.74 118.16 116.22 1xi9 n LYS 42 Ca 0.02 0.21 0.00 0.00 -2.87 0.00 0.00 58.31 55.67 1xi9 n LYS 42 Cb 0.31 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.00 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 -1.49 0.00 -1.77 2.13 3.72 -0.35 -5.01 117.46 114.69 1xi9 n PHE 43 Ca 0.04 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.09 1xi9 n PHE 43 Cb 0.19 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.74 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 7.19 -3.92 4.37 3.85 -1.26 -4.88 116.55 121.91 1xi9 n ASP 44 Ca 0.00 -3.63 -0.18 0.00 -0.71 0.00 0.00 54.79 50.27 1xi9 n ASP 44 Cb 0.00 -1.12 -0.15 0.00 -1.35 0.00 0.00 41.12 38.49 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 -3.30 0.60 0.07 2.11 0.40 -1.22 -5.08 117.98 111.55 1xi9 s PHE 45 Ca 0.54 -0.13 0.02 0.00 -0.60 0.00 0.00 56.93 56.76 1xi9 s PHE 45 Cb 0.42 -0.49 -0.03 0.00 0.51 0.00 0.00 43.02 43.43 1xi9 s PHE 45 CO -0.35 -0.10 -0.07 -0.65 0.70 0.00 0.00 175.22 174.75 1xi9 s GLN 46 N 0.45 0.67 0.41 0.44 -1.52 -1.26 -4.02 119.66 114.84 1xi9 s GLN 46 Ca -0.05 -1.06 -0.27 0.00 -1.95 0.00 0.00 55.36 52.03 1xi9 s GLN 46 Cb -0.09 -0.20 -0.09 0.00 -0.22 0.00 0.00 33.01 32.40 1xi9 s GLN 46 CO -0.00 0.00 1.44 -1.25 -0.25 0.00 0.00 175.29 175.23 1xi9 s PRO 47 N -2.80 3.90 0.83 2.91 0.04 -1.11 -4.78 135.00 133.98 1xi9 s PRO 47 Ca 0.01 2.45 -0.12 0.00 0.04 0.00 0.00 61.00 63.38 1xi9 s PRO 47 Cb -0.02 -2.80 0.10 0.00 0.04 0.00 0.00 34.50 31.82 1xi9 s PRO 47 CO -0.03 -0.65 1.18 -1.25 0.04 0.00 0.00 177.00 176.29 1xi9 s PRO 48 N -2.27 1.52 0.20 0.56 0.04 -1.26 -4.74 135.00 129.05 1xi9 s PRO 48 Ca 0.57 1.67 -0.11 0.00 0.04 0.00 0.00 61.00 63.17 1xi9 s PRO 48 Cb -0.44 -1.77 0.14 0.00 0.04 0.00 0.00 34.50 32.47 1xi9 s PRO 48 CO 0.58 -2.29 1.86 1.49 0.04 0.00 0.00 177.00 178.69 1xi9 h GLU 49 N -1.15 0.96 0.00 4.56 4.57 -1.99 -2.08 114.58 119.45 1xi9 h GLU 49 Ca -0.45 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 57.65 1xi9 h GLU 49 Cb 1.28 -0.21 -0.00 0.00 -0.16 0.00 0.00 28.75 29.66 1xi9 h GLU 49 CO 0.45 0.65 -0.05 1.12 -1.18 0.00 0.00 179.01 180.01 1xi9 h HIS 50 N 0.98 0.00 0.18 0.92 2.07 -1.97 0.44 115.15 117.77 1xi9 h HIS 50 Ca 0.26 0.00 -0.25 0.00 -2.85 0.00 0.00 60.37 57.53 1xi9 h HIS 50 Cb -0.08 0.00 0.02 0.00 2.57 0.00 0.00 27.41 29.92 1xi9 h HIS 50 CO -0.02 0.05 -1.12 0.52 -3.07 0.00 0.00 177.93 174.29 1xi9 h MET 51 N 0.00 0.37 0.31 5.12 2.86 -1.69 -2.96 114.93 118.94 1xi9 h MET 51 Ca -0.00 -0.64 0.00 0.00 -2.06 0.00 0.00 59.70 57.01 1xi9 h MET 51 Cb 0.31 0.24 -0.02 0.00 0.06 0.00 0.00 31.60 32.19 1xi9 h MET 51 CO 0.01 1.30 -0.33 0.87 1.06 0.00 0.00 176.91 179.82 1xi9 h LYS 52 N -0.19 -0.66 -0.75 1.72 1.57 -0.95 -1.46 116.57 115.85 1xi9 h LYS 52 Ca -0.20 0.04 0.15 0.00 -1.87 0.00 0.00 60.65 58.77 1xi9 h LYS 52 Cb 1.83 0.15 -0.10 0.00 0.08 0.00 0.00 32.23 34.19 1xi9 h LYS 52 CO 0.18 -0.44 0.27 1.49 -0.57 0.00 0.00 179.45 180.38 1xi9 h GLU 53 N -0.68 0.37 -0.57 3.15 4.57 -1.07 -1.20 114.58 119.15 1xi9 h GLU 53 Ca -0.01 -0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.09 1xi9 h GLU 53 Cb 0.63 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.11 1xi9 h GLU 53 CO -0.07 0.25 0.14 0.00 -1.18 0.00 0.00 179.01 178.15 1xi9 h ALA 54 N 1.57 1.18 0.33 2.92 0.00 -1.33 0.26 119.26 124.19 1xi9 h ALA 54 Ca 0.42 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1xi9 h ALA 54 Cb 0.67 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1xi9 h ALA 54 CO -0.44 0.56 -0.16 -0.92 0.00 0.00 0.00 179.25 178.29 1xi9 h TYR 55 N 0.85 -0.41 -0.91 0.00 5.03 -0.29 -1.01 116.97 120.23 1xi9 h TYR 55 Ca 0.19 -0.01 0.04 0.00 2.58 0.00 0.00 58.73 61.53 1xi9 h TYR 55 Cb 0.30 0.14 -0.06 0.00 1.55 0.00 0.00 36.73 38.66 1xi9 h TYR 55 CO 0.02 -0.12 0.59 0.00 -1.32 0.00 0.00 178.16 177.32 1xi9 h LYS 57 N 1.11 1.00 -0.57 0.00 3.64 -0.85 -2.01 116.57 118.90 1xi9 h LYS 57 Ca 0.37 -0.34 0.07 0.00 -1.27 0.00 0.00 60.65 59.48 1xi9 h LYS 57 Cb 0.06 -0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 31.74 1xi9 h LYS 57 CO -0.14 1.02 0.26 0.00 -2.27 0.00 0.00 179.45 178.32 1xi9 h ALA 58 N 0.95 0.74 0.83 5.00 0.00 -0.91 -0.62 119.26 125.25 1xi9 h ALA 58 Ca 0.15 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1xi9 h ALA 58 Cb 0.59 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.37 1xi9 h ALA 58 CO 0.04 -0.12 -0.40 0.82 0.00 0.00 0.00 179.25 179.59 1xi9 h ILE 59 N 0.48 0.00 -0.94 0.00 2.04 -1.26 0.63 117.51 118.46 1xi9 h ILE 59 Ca 0.27 -0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.27 1xi9 h ILE 59 Cb 0.25 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.24 1xi9 h ILE 59 CO -0.23 0.00 0.56 0.11 0.00 0.00 0.00 178.15 178.59 1xi9 h LYS 60 N -1.12 0.79 0.00 2.37 1.57 -1.34 0.35 116.57 119.19 1xi9 h LYS 60 Ca -0.11 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 1xi9 h LYS 60 Cb 0.86 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.99 1xi9 h LYS 60 CO 0.19 0.52 0.00 0.39 -0.57 0.00 0.00 179.45 179.98 1xi9 n GLU 61 N -4.74 0.81 -0.63 3.15 1.02 -0.24 -4.87 120.64 115.13 1xi9 n GLU 61 Ca 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.33 1xi9 n GLU 61 Cb 0.43 -1.14 0.00 0.00 -0.02 0.00 0.00 31.44 30.71 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 0.40 0.65 2.56 0.62 0.00 0.11 -4.97 105.19 104.56 1xi9 n GLY 62 Ca 0.05 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.63 2.78 -0.64 1.61 8.25 0.19 -4.47 115.22 120.31 1xi9 n HIS 63 Ca 0.00 -2.92 0.05 0.00 -0.26 0.00 0.00 57.72 54.60 1xi9 n HIS 63 Cb 0.00 -2.17 0.07 0.00 1.12 0.00 0.00 29.99 29.02 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 3.46 2.10 -4.95 0.41 3.02 -1.26 -3.47 115.26 114.57 1xi9 n ASN 64 Ca 0.60 -2.56 -0.20 0.00 -0.03 0.00 0.00 54.58 52.39 1xi9 n ASN 64 Cb 0.29 -0.23 0.04 0.00 -0.61 0.00 0.00 39.78 39.27 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 -1.95 2.46 0.22 3.10 1.13 -1.26 -5.04 117.35 116.00 1xi9 s TYR 65 Ca 0.17 -0.25 -0.30 0.00 -1.41 0.00 0.00 57.07 55.28 1xi9 s TYR 65 Cb 0.15 -2.62 -0.09 0.00 -1.10 0.00 0.00 41.96 38.30 1xi9 s TYR 65 CO 0.02 -0.92 1.28 0.71 -2.51 0.00 0.00 175.55 174.13 1xi9 s TYR 66 N -2.70 3.27 0.59 -3.49 4.12 -1.26 -4.65 117.35 113.23 1xi9 s TYR 66 Ca 0.59 1.29 0.07 0.00 0.02 0.00 0.00 57.07 59.04 1xi9 s TYR 66 Cb -0.09 -3.58 0.09 0.00 -1.52 0.00 0.00 41.96 36.86 1xi9 s TYR 66 CO 0.38 -1.73 0.82 0.20 0.02 0.00 0.00 175.55 175.24 1xi9 s GLY 67 N 0.15 1.76 0.27 0.71 0.00 -1.26 -5.05 107.32 103.89 1xi9 s GLY 67 Ca 0.55 -1.99 -0.29 0.00 0.00 0.00 0.00 44.72 42.99 1xi9 s GLY 67 CO 0.40 -1.54 1.06 1.34 0.00 0.00 0.00 173.10 174.36 1xi9 n ASP 68 N -2.34 1.41 0.31 1.64 2.03 -1.26 -4.71 116.55 113.62 1xi9 n ASP 68 Ca 0.15 1.17 0.20 0.00 0.52 0.00 0.00 54.79 56.83 1xi9 n ASP 68 Cb 0.61 -1.29 0.96 0.00 -0.72 0.00 0.00 41.12 40.68 1xi9 n ASP 68 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1xi9 h SER 69 N 2.30 0.00 0.96 1.67 4.64 -1.91 -1.94 113.55 119.28 1xi9 h SER 69 Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1xi9 h SER 69 Cb 1.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 1xi9 h SER 69 CO 0.63 0.01 -0.50 -0.62 -0.87 0.00 0.00 176.83 175.48 1xi9 n GLU 70 N -3.14 0.27 0.00 4.77 1.02 -1.26 -4.79 120.64 117.51 1xi9 n GLU 70 Ca -0.01 0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 1xi9 n GLU 70 Cb 0.18 -1.69 0.00 0.00 -0.02 0.00 0.00 31.44 29.91 1xi9 n GLU 70 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xi9 n GLY 71 N 1.34 2.52 3.59 0.62 0.00 -0.73 -1.70 105.19 110.84 1xi9 n GLY 71 Ca 0.04 -1.73 -0.54 0.00 0.00 0.00 0.00 46.02 43.78 1xi9 n GLY 71 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xi9 n LEU 72 N 0.00 1.42 -0.25 0.99 4.32 -1.26 -4.74 117.00 117.48 1xi9 n LEU 72 Ca 0.00 1.12 0.16 0.00 -0.02 0.00 0.00 56.01 57.27 1xi9 n LEU 72 Cb 0.00 -1.13 0.45 0.00 -1.62 0.00 0.00 43.42 41.12 1xi9 n LEU 72 CO 0.00 -1.13 1.22 -0.65 -1.22 0.00 0.00 177.39 175.61 1xi9 h PRO 73 N 4.59 0.52 -0.72 3.23 0.11 -1.97 -1.42 132.00 136.34 1xi9 h PRO 73 Ca -0.48 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 1xi9 h PRO 73 Cb 1.35 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 1xi9 h PRO 73 CO 0.78 0.35 0.29 0.93 -0.21 0.00 0.00 178.00 180.14 1xi9 h GLU 74 N 0.54 1.08 -0.26 1.05 5.08 -1.99 -2.01 114.58 118.07 1xi9 h GLU 74 Ca 0.46 -0.19 -0.12 0.00 -1.00 0.00 0.00 59.36 58.51 1xi9 h GLU 74 Cb 0.94 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.01 1xi9 h GLU 74 CO -0.20 0.88 -0.30 1.25 -1.00 0.00 0.00 179.01 179.65 1xi9 h LEU 75 N 1.03 0.70 -1.02 1.33 5.85 -1.66 -1.43 115.31 120.11 1xi9 h LEU 75 Ca 0.24 -0.49 0.02 0.00 0.84 0.00 0.00 57.88 58.49 1xi9 h LEU 75 Cb 0.20 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 40.98 1xi9 h LEU 75 CO -0.02 1.05 0.66 0.03 -0.34 0.00 0.00 178.44 179.82 1xi9 h ARG 76 N 0.37 1.27 -0.53 1.25 3.08 -1.26 -0.05 114.38 118.52 1xi9 h ARG 76 Ca 0.04 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 1xi9 h ARG 76 Cb 0.87 -0.29 -0.02 0.00 0.08 0.00 0.00 29.97 30.61 1xi9 h ARG 76 CO 0.07 0.84 0.17 -0.22 -1.07 0.00 0.00 179.97 179.76 1xi9 h LYS 77 N 1.31 0.83 -0.48 0.04 3.64 -1.34 -2.29 116.57 118.28 1xi9 h LYS 77 Ca 0.38 -0.18 -0.05 0.00 -1.27 0.00 0.00 60.65 59.53 1xi9 h LYS 77 Cb -0.09 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.59 1xi9 h LYS 77 CO -0.10 0.76 0.09 0.00 -2.27 0.00 0.00 179.45 177.93 1xi9 h ALA 78 N 1.03 1.25 0.10 5.00 0.00 -0.45 -2.50 119.26 123.69 1xi9 h ALA 78 Ca 0.17 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1xi9 h ALA 78 Cb 0.28 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1xi9 h ALA 78 CO -0.01 0.52 -0.05 0.82 0.00 0.00 0.00 179.25 180.53 1xi9 h ILE 79 N 0.72 1.05 -0.78 0.00 2.04 -1.00 -1.89 117.51 117.65 1xi9 h ILE 79 Ca 0.16 -0.56 0.18 0.00 1.00 0.00 0.00 64.86 65.63 1xi9 h ILE 79 Cb 0.31 1.41 -0.12 0.00 -0.74 0.00 0.00 36.82 37.67 1xi9 h ILE 79 CO 0.00 0.14 0.13 0.58 0.00 0.00 0.00 178.15 179.00 1xi9 h VAL 80 N -0.40 0.40 -0.12 1.67 2.07 -1.26 0.08 116.25 118.69 1xi9 h VAL 80 Ca -0.01 -0.07 -0.09 0.00 0.82 0.00 0.00 66.70 67.35 1xi9 h VAL 80 Cb 0.33 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 1xi9 h VAL 80 CO 0.02 0.04 -0.28 -0.33 0.02 0.00 0.00 177.57 177.04 1xi9 h GLU 81 N 0.19 0.40 -0.97 1.57 5.08 -1.43 -2.47 114.58 116.96 1xi9 h GLU 81 Ca 0.45 -0.27 0.02 0.00 -1.00 0.00 0.00 59.36 58.55 1xi9 h GLU 81 Cb 0.81 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 30.05 1xi9 h GLU 81 CO -0.60 0.88 0.64 -0.09 -1.00 0.00 0.00 179.01 178.84 1xi9 h ARG 82 N -0.02 1.25 0.00 2.33 1.12 -0.69 -0.99 114.38 117.39 1xi9 h ARG 82 Ca -0.00 -0.08 -0.11 0.00 -1.11 0.00 0.00 59.98 58.68 1xi9 h ARG 82 Cb 0.88 -0.28 -0.02 0.00 -0.01 0.00 0.00 29.97 30.54 1xi9 h ARG 82 CO 0.06 0.83 -0.54 0.93 -3.11 0.00 0.00 179.97 178.14 1xi9 h GLU 83 N 1.29 0.00 0.03 0.20 4.39 -1.04 -1.85 114.58 117.61 1xi9 h GLU 83 Ca 0.36 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.06 1xi9 h GLU 83 Cb -0.11 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.54 1xi9 h GLU 83 CO -0.09 0.54 -0.01 0.87 -1.16 0.00 0.00 179.01 179.16 1xi9 h LYS 84 N 0.00 -0.04 -0.12 2.33 6.56 -0.96 0.58 116.57 124.91 1xi9 h LYS 84 Ca -0.01 0.00 0.05 0.00 -1.06 0.00 0.00 60.65 59.63 1xi9 h LYS 84 Cb 1.17 0.01 -0.06 0.00 -0.57 0.00 0.00 32.23 32.78 1xi9 h LYS 84 CO 0.07 0.29 -0.28 0.00 -2.06 0.00 0.00 179.45 177.47 1xi9 h ARG 85 N -0.38 -0.35 0.15 3.15 3.08 -1.11 -0.09 114.38 118.83 1xi9 h ARG 85 Ca -0.00 0.02 -0.21 0.00 0.07 0.00 0.00 59.98 59.86 1xi9 h ARG 85 Cb 0.35 0.08 0.02 0.00 0.08 0.00 0.00 29.97 30.50 1xi9 h ARG 85 CO 0.01 -0.23 -0.95 -0.22 -1.07 0.00 0.00 179.97 177.50 1xi9 h LYS 86 N -0.36 0.32 -0.01 0.04 3.64 -1.40 -3.40 116.57 115.40 1xi9 h LYS 86 Ca 0.10 -0.55 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1xi9 h LYS 86 Cb 0.51 0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1xi9 h LYS 86 CO -0.32 1.26 -0.18 0.09 -2.27 0.00 0.00 179.45 178.02 1xi9 n ASN 87 N -4.06 1.55 -0.06 4.20 3.02 0.18 -4.99 115.26 115.10 1xi9 n ASN 87 Ca -0.15 -1.28 -0.01 0.00 -0.03 0.00 0.00 54.58 53.11 1xi9 n ASN 87 Cb 0.86 0.34 -0.00 0.00 -0.61 0.00 0.00 39.78 40.37 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 0.91 0.12 3.78 7.41 0.00 -0.05 -4.42 105.19 112.95 1xi9 n GLY 88 Ca 0.06 -0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.17 3.96 -0.39 1.61 -7.23 -1.24 -4.95 120.40 110.99 1xi9 s VAL 89 Ca 0.00 1.64 -0.09 0.00 -1.81 0.00 0.00 61.98 61.72 1xi9 s VAL 89 Cb 0.00 -3.91 0.06 0.00 0.56 0.00 0.00 36.38 33.09 1xi9 s VAL 89 CO 0.00 0.14 0.21 -1.81 -0.31 0.00 0.00 175.10 173.33 1xi9 s ASP 90 N -1.49 5.59 0.13 4.85 -0.00 -1.26 -4.04 116.67 120.45 1xi9 s ASP 90 Ca 0.52 -1.32 0.03 0.00 -0.00 0.00 0.00 52.55 51.78 1xi9 s ASP 90 Cb -0.22 -1.97 -0.04 0.00 -0.00 0.00 0.00 42.92 40.69 1xi9 s ASP 90 CO 0.27 -0.46 -0.08 0.27 -0.00 0.00 0.00 175.17 175.17 1xi9 s ILE 91 N 1.45 0.98 0.32 0.77 -4.36 -1.26 -5.01 121.20 114.08 1xi9 s ILE 91 Ca 0.02 -2.01 0.09 0.00 -0.26 0.00 0.00 60.65 58.49 1xi9 s ILE 91 Cb -0.21 -1.80 -0.05 0.00 1.25 0.00 0.00 42.46 41.65 1xi9 s ILE 91 CO 0.03 -0.78 0.05 0.42 0.24 0.00 0.00 174.94 174.90 1xi9 s THR 92 N -3.45 3.01 0.54 8.37 -4.23 -1.26 -4.95 115.64 113.68 1xi9 s THR 92 Ca 0.15 -1.86 0.32 0.00 -1.18 0.00 0.00 61.69 59.12 1xi9 s THR 92 Cb 0.04 -2.87 0.49 0.00 1.34 0.00 0.00 72.50 71.50 1xi9 s THR 92 CO -0.01 -0.25 1.87 -0.65 -0.54 0.00 0.00 174.62 175.04 1xi9 h PRO 93 N 1.75 0.00 0.00 3.99 0.11 -1.96 -0.09 132.00 135.80 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 0.63 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.17 1xi9 n ASP 94 N -4.19 0.00 -0.64 -2.05 9.92 -1.26 -2.16 116.55 116.17 1xi9 n ASP 94 Ca 0.19 -0.06 0.13 0.00 -0.53 0.00 0.00 54.79 54.52 1xi9 n ASP 94 Cb 0.99 -0.29 0.38 0.00 -0.64 0.00 0.00 41.12 41.56 1xi9 n ASP 94 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1xi9 n ASP 95 N -1.29 2.00 -4.35 -2.24 10.43 -0.05 -4.94 116.55 116.12 1xi9 n ASP 95 Ca 0.12 -1.67 -0.32 0.00 2.57 0.00 0.00 54.79 55.49 1xi9 n ASP 95 Cb 0.20 -0.01 -0.15 0.00 1.84 0.00 0.00 41.12 43.01 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 -1.99 2.56 -0.08 2.53 1.01 -0.92 -1.27 120.40 122.25 1xi9 s VAL 96 Ca 0.35 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.46 1xi9 s VAL 96 Cb 0.21 -1.99 0.02 0.00 0.00 0.00 0.00 36.38 34.61 1xi9 s VAL 96 CO 0.32 0.56 -0.10 -0.13 0.00 0.00 0.00 175.10 175.76 1xi9 s ARG 97 N -0.17 1.51 0.11 2.72 1.81 0.07 -4.94 118.95 120.07 1xi9 s ARG 97 Ca -0.02 -0.31 -0.26 0.00 -1.72 0.00 0.00 55.73 53.42 1xi9 s ARG 97 Cb -0.14 -1.38 -0.07 0.00 -0.45 0.00 0.00 34.95 32.92 1xi9 s ARG 97 CO 0.04 -0.08 0.80 0.08 -0.68 0.00 0.00 175.30 175.45 1xi9 s VAL 98 N 1.04 4.53 0.22 3.52 1.01 -0.69 -0.43 120.40 129.61 1xi9 s VAL 98 Ca -0.08 1.73 0.02 0.00 0.00 0.00 0.00 61.98 63.66 1xi9 s VAL 98 Cb -0.15 -4.16 -0.05 0.00 0.00 0.00 0.00 36.38 32.03 1xi9 s VAL 98 CO -0.01 0.43 0.03 0.42 0.00 0.00 0.00 175.10 175.98 1xi9 s THR 99 N -0.54 0.78 -1.38 3.92 -4.23 -0.75 -4.54 115.64 108.89 1xi9 s THR 99 Ca 0.38 -2.00 -0.15 0.00 -1.18 0.00 0.00 61.69 58.74 1xi9 s THR 99 Cb -0.22 -2.38 0.06 0.00 1.34 0.00 0.00 72.50 71.30 1xi9 s THR 99 CO 0.25 -0.26 2.00 0.00 -0.54 0.00 0.00 174.62 176.07 1xi9 n ALA 100 N -0.38 4.71 -0.38 3.99 0.00 -1.26 -1.58 120.51 125.60 1xi9 n ALA 100 Ca -0.04 -3.90 0.04 0.00 0.00 0.00 0.00 53.44 49.54 1xi9 n ALA 100 Cb 0.64 -3.53 -0.01 0.00 0.00 0.00 0.00 19.45 16.56 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 6.88 -0.80 0.15 0.00 0.00 -1.07 -2.93 120.51 122.74 1xi9 n ALA 101 Ca 0.50 0.10 -0.00 0.00 0.00 0.00 0.00 53.44 54.03 1xi9 n ALA 101 Cb 0.42 -0.28 0.22 0.00 0.00 0.00 0.00 19.45 19.81 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 -0.29 1.39 -0.31 0.00 2.07 -1.85 -2.98 116.25 114.28 1xi9 h VAL 102 Ca 0.01 -1.87 0.07 0.00 0.82 0.00 0.00 66.70 65.72 1xi9 h VAL 102 Cb 0.28 2.00 -0.08 0.00 -1.52 0.00 0.00 31.29 31.97 1xi9 h VAL 102 CO 0.00 0.54 -0.31 0.74 0.02 0.00 0.00 177.57 178.56 1xi9 h THR 103 N 0.01 0.26 -0.46 2.57 2.02 -1.98 0.10 112.91 115.43 1xi9 h THR 103 Ca -0.00 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.09 1xi9 h THR 103 Cb 0.97 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 1xi9 h THR 103 CO 0.07 0.00 -0.06 -0.08 0.37 0.00 0.00 175.52 175.82 1xi9 h GLU 104 N -0.29 0.81 -0.26 6.66 4.81 -1.46 -2.05 114.58 122.79 1xi9 h GLU 104 Ca 0.15 -0.25 0.06 0.00 -0.13 0.00 0.00 59.36 59.19 1xi9 h GLU 104 Cb 0.53 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.78 1xi9 h GLU 104 CO -0.47 0.85 -0.09 0.00 -0.73 0.00 0.00 179.01 178.56 1xi9 h ALA 105 N 1.19 0.13 -0.53 2.92 0.00 -1.22 0.68 119.26 122.44 1xi9 h ALA 105 Ca 0.13 0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.19 1xi9 h ALA 105 Cb 0.53 0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.53 1xi9 h ALA 105 CO 0.03 -0.50 0.27 -0.07 0.00 0.00 0.00 179.25 178.98 1xi9 h LEU 106 N -0.04 0.39 -0.45 0.00 3.38 -0.66 0.65 115.31 118.58 1xi9 h LEU 106 Ca 0.13 0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.16 1xi9 h LEU 106 Cb 0.24 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 1xi9 h LEU 106 CO -0.29 0.27 0.26 1.56 0.09 0.00 0.00 178.44 180.32 1xi9 h GLN 107 N 0.53 0.50 -0.51 1.13 4.20 -0.77 -0.30 115.11 119.88 1xi9 h GLN 107 Ca 0.24 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.87 1xi9 h GLN 107 Cb 0.14 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 1xi9 h GLN 107 CO -0.16 0.33 0.15 -0.07 -0.67 0.00 0.00 178.83 178.40 1xi9 h LEU 108 N 0.51 0.76 0.03 1.46 3.38 -0.51 -0.44 115.31 120.51 1xi9 h LEU 108 Ca 0.19 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1xi9 h LEU 108 Cb 0.04 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.59 1xi9 h LEU 108 CO -0.10 0.78 -0.01 0.40 0.09 0.00 0.00 178.44 179.60 1xi9 h ILE 109 N 0.71 1.27 -0.23 1.22 2.04 -0.66 -1.18 117.51 120.68 1xi9 h ILE 109 Ca 0.16 -0.97 -0.05 0.00 1.00 0.00 0.00 64.86 65.01 1xi9 h ILE 109 Cb 0.30 1.92 -0.01 0.00 -0.74 0.00 0.00 36.82 38.29 1xi9 h ILE 109 CO -0.00 0.25 -0.06 -0.26 0.00 0.00 0.00 178.15 178.07 1xi9 h PHE 110 N -0.46 0.51 -0.96 1.37 0.05 -1.11 -0.88 116.94 115.45 1xi9 h PHE 110 Ca -0.00 -0.11 0.16 0.00 3.82 0.00 0.00 57.97 61.84 1xi9 h PHE 110 Cb 0.43 -0.12 -0.10 0.00 2.00 0.00 0.00 35.95 38.16 1xi9 h PHE 110 CO 0.07 0.68 0.56 0.78 -0.18 0.00 0.00 178.31 180.23 1xi9 h GLY 111 N 0.19 1.64 1.76 -1.45 0.00 -1.13 0.16 103.07 104.24 1xi9 h GLY 111 Ca 0.06 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.05 1xi9 h GLY 111 CO 0.02 -0.01 -0.23 0.00 0.00 0.00 0.00 176.54 176.33 1xi9 h ALA 112 N 1.60 0.88 0.00 3.60 0.00 -0.96 -3.38 119.26 121.00 1xi9 h ALA 112 Ca 0.53 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 55.12 1xi9 h ALA 112 Cb 0.74 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.47 1xi9 h ALA 112 CO -0.35 0.00 -2.22 -0.11 0.00 0.00 0.00 179.25 176.57 1xi9 n LEU 113 N -2.77 0.97 -4.68 0.00 7.94 -0.36 -4.86 117.00 113.24 1xi9 n LEU 113 Ca 0.04 -0.04 -0.37 0.00 -1.11 0.00 0.00 56.01 54.53 1xi9 n LEU 113 Cb 0.50 0.03 -0.08 0.00 0.53 0.00 0.00 43.42 44.41 1xi9 n LEU 113 CO 0.34 0.58 -0.02 -0.76 -1.11 0.00 0.00 177.39 176.42 1xi9 s LEU 114 N -5.61 4.16 0.18 -1.96 1.43 -0.01 -5.06 118.68 111.81 1xi9 s LEU 114 Ca -0.16 0.37 0.04 0.00 -1.03 0.00 0.00 54.13 53.35 1xi9 s LEU 114 Cb 0.06 -2.34 -0.03 0.00 0.03 0.00 0.00 46.19 43.91 1xi9 s LEU 114 CO 0.65 0.02 0.30 -1.81 0.23 0.00 0.00 176.35 175.73 1xi9 s ASP 115 N 0.89 6.26 0.10 2.29 -0.00 -1.26 -4.93 116.67 120.02 1xi9 s ASP 115 Ca 0.14 0.11 -0.35 0.00 -0.00 0.00 0.00 52.55 52.45 1xi9 s ASP 115 Cb -0.14 -1.85 -0.15 0.00 -0.00 0.00 0.00 42.92 40.79 1xi9 s ASP 115 CO 0.05 0.01 1.54 -2.65 -0.00 0.00 0.00 175.17 174.13 1xi9 n PRO 116 N -0.83 1.85 -0.10 8.23 -0.02 -1.26 -1.45 135.00 141.41 1xi9 n PRO 116 Ca -0.08 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1xi9 n PRO 116 Cb 0.55 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 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 3.28 1.66 3.75 -1.23 0.00 0.48 -4.96 105.19 108.17 1xi9 n GLY 117 Ca 0.18 0.00 -0.35 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 -3.18 5.05 0.12 1.61 -0.00 -0.53 -4.64 116.67 115.10 1xi9 s ASP 118 Ca 0.00 2.27 0.06 0.00 -0.00 0.00 0.00 52.55 54.89 1xi9 s ASP 118 Cb 0.00 -2.58 -0.04 0.00 -0.00 0.00 0.00 42.92 40.30 1xi9 s ASP 118 CO 0.00 -1.68 -0.02 -1.61 -0.00 0.00 0.00 175.17 171.86 1xi9 s GLU 119 N -3.59 2.42 -0.08 8.23 2.02 0.26 -0.04 118.70 127.91 1xi9 s GLU 119 Ca 0.74 -0.97 0.00 0.00 0.02 0.00 0.00 54.97 54.77 1xi9 s GLU 119 Cb -0.27 -2.43 0.02 0.00 0.10 0.00 0.00 34.13 31.55 1xi9 s GLU 119 CO 0.36 0.50 -0.07 0.42 0.02 0.00 0.00 175.26 176.50 1xi9 s ILE 120 N -1.44 0.85 -0.20 -1.63 -1.09 -0.68 -0.04 121.20 116.97 1xi9 s ILE 120 Ca 0.26 -0.22 -0.29 0.00 -2.23 0.00 0.00 60.65 58.16 1xi9 s ILE 120 Cb -0.11 -0.87 0.00 0.00 -1.58 0.00 0.00 42.46 39.91 1xi9 s ILE 120 CO 0.18 0.32 1.03 -0.76 -1.23 0.00 0.00 174.94 174.48 1xi9 s LEU 121 N 1.41 4.14 0.17 2.97 1.43 -0.59 -0.40 118.68 127.80 1xi9 s LEU 121 Ca -0.02 1.41 0.10 0.00 -1.03 0.00 0.00 54.13 54.59 1xi9 s LEU 121 Cb -0.13 -3.54 -0.04 0.00 0.03 0.00 0.00 46.19 42.51 1xi9 s LEU 121 CO -0.04 -0.61 -0.21 0.68 0.23 0.00 0.00 176.35 176.40 1xi9 s VAL 122 N 2.89 2.02 0.66 -1.59 -7.23 0.34 -0.29 120.40 117.20 1xi9 s VAL 122 Ca 0.45 -1.90 -0.15 0.00 -1.81 0.00 0.00 61.98 58.57 1xi9 s VAL 122 Cb -0.16 -1.92 0.00 0.00 0.56 0.00 0.00 36.38 34.87 1xi9 s VAL 122 CO 0.09 -0.19 1.12 -2.16 -0.31 0.00 0.00 175.10 173.65 1xi9 s PRO 123 N -2.60 2.75 -0.09 4.82 0.04 -1.26 -0.84 135.00 137.82 1xi9 s PRO 123 Ca 0.16 1.42 -0.00 0.00 0.04 0.00 0.00 61.00 62.62 1xi9 s PRO 123 Cb -0.07 -1.94 0.02 0.00 0.04 0.00 0.00 34.50 32.55 1xi9 s PRO 123 CO 0.07 -1.29 -0.07 0.20 0.04 0.00 0.00 177.00 175.95 1xi9 s GLY 124 N -2.54 0.74 0.46 0.56 0.00 0.25 -3.01 107.32 103.79 1xi9 s GLY 124 Ca 0.67 -0.43 -0.25 0.00 0.00 0.00 0.00 44.72 44.72 1xi9 s GLY 124 CO 0.42 0.72 1.34 -1.05 0.00 0.00 0.00 173.10 174.53 1xi9 n PRO 125 N 4.73 1.99 -3.86 2.90 -0.02 -1.26 -1.86 135.00 137.62 1xi9 n PRO 125 Ca -0.14 0.71 -0.21 0.00 -2.02 0.00 0.00 63.50 61.85 1xi9 n PRO 125 Cb 0.50 -2.51 -0.02 0.00 -0.02 0.00 0.00 33.50 31.45 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 -0.59 6.16 -0.27 2.55 1.04 -0.65 -4.65 113.70 117.29 1xi9 s SER 126 Ca 0.63 -0.03 -0.13 0.00 0.48 0.00 0.00 55.95 56.90 1xi9 s SER 126 Cb -0.47 -1.66 -0.04 0.00 0.10 0.00 0.00 66.02 63.95 1xi9 s SER 126 CO 0.56 -0.16 0.29 -0.47 0.98 0.00 0.00 173.24 174.44 1xi9 s TYR 127 N -2.04 3.24 0.28 5.02 6.04 -1.26 -4.60 117.35 124.02 1xi9 s TYR 127 Ca 0.37 0.29 0.01 0.00 0.04 0.00 0.00 57.07 57.78 1xi9 s TYR 127 Cb -0.09 -2.48 0.62 0.00 -1.04 0.00 0.00 41.96 38.97 1xi9 s TYR 127 CO 0.29 -0.18 1.73 -1.35 -1.54 0.00 0.00 175.55 174.50 1xi9 h PRO 128 N 8.20 0.52 -0.83 4.97 0.11 -1.95 -2.59 132.00 140.43 1xi9 h PRO 128 Ca -0.33 -0.03 0.16 0.00 0.11 0.00 0.00 66.00 65.91 1xi9 h PRO 128 Cb 1.17 -0.12 -0.10 0.00 0.11 0.00 0.00 31.00 32.06 1xi9 h PRO 128 CO 0.61 0.34 0.38 -1.35 -0.21 0.00 0.00 178.00 177.78 1xi9 h PRO 129 N 0.53 0.50 -0.33 1.05 0.11 -1.95 -1.99 132.00 129.93 1xi9 h PRO 129 Ca 0.51 -0.03 0.07 0.00 0.11 0.00 0.00 66.00 66.66 1xi9 h PRO 129 Cb 0.83 -0.11 -0.07 0.00 0.11 0.00 0.00 31.00 31.76 1xi9 h PRO 129 CO -0.43 0.33 -0.13 1.88 -0.21 0.00 0.00 178.00 179.44 1xi9 h TYR 130 N 0.51 -0.31 0.52 0.65 -1.99 -1.90 -1.10 116.97 113.35 1xi9 h TYR 130 Ca 0.47 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 61.22 1xi9 h TYR 130 Cb 0.75 0.19 -0.00 0.00 2.00 0.00 0.00 36.73 39.66 1xi9 h TYR 130 CO -0.13 -0.20 -0.30 1.15 -0.00 0.00 0.00 178.16 178.68 1xi9 h THR 131 N -0.07 0.38 -0.72 -2.88 2.02 -1.47 -1.32 112.91 108.84 1xi9 h THR 131 Ca 0.16 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.32 1xi9 h THR 131 Cb 0.32 0.38 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 1xi9 h THR 131 CO -0.38 0.00 0.35 1.23 0.37 0.00 0.00 175.52 177.09 1xi9 h GLY 132 N -0.77 1.10 0.82 2.16 0.00 -1.40 -1.19 103.07 103.79 1xi9 h GLY 132 Ca -0.06 -0.53 -0.08 0.00 0.00 0.00 0.00 47.33 46.66 1xi9 h GLY 132 CO 0.07 0.51 -0.21 1.41 0.00 0.00 0.00 176.54 178.32 1xi9 h LEU 133 N 1.03 0.51 -0.40 3.11 3.38 -1.16 -0.23 115.31 121.55 1xi9 h LEU 133 Ca 0.25 -0.49 0.01 0.00 0.09 0.00 0.00 57.88 57.74 1xi9 h LEU 133 Cb 0.10 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1xi9 h LEU 133 CO -0.03 0.89 0.25 0.58 0.09 0.00 0.00 178.44 180.22 1xi9 h VAL 134 N 0.13 1.08 -0.33 1.22 2.07 -1.11 -2.56 116.25 116.75 1xi9 h VAL 134 Ca 0.03 -0.18 -0.08 0.00 0.82 0.00 0.00 66.70 67.29 1xi9 h VAL 134 Cb 0.76 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 1xi9 h VAL 134 CO 0.05 0.09 -0.12 0.11 0.02 0.00 0.00 177.57 177.72 1xi9 h LYS 135 N 0.51 0.57 -0.67 1.57 1.57 -1.23 0.79 116.57 119.67 1xi9 h LYS 135 Ca 0.15 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1xi9 h LYS 135 Cb -0.03 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 1xi9 h LYS 135 CO -0.05 0.68 0.34 0.35 -0.57 0.00 0.00 179.45 180.20 1xi9 h PHE 136 N 0.52 0.93 -0.39 -1.35 3.57 -0.64 -1.97 116.94 117.61 1xi9 h PHE 136 Ca 0.09 -0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.42 1xi9 h PHE 136 Cb 0.52 -0.30 -0.09 0.00 2.79 0.00 0.00 35.95 38.87 1xi9 h PHE 136 CO 0.02 0.67 0.19 0.66 -2.23 0.00 0.00 178.31 177.62 1xi9 n TYR 137 N -4.35 1.26 -0.80 0.41 4.02 -1.01 -4.86 117.16 111.82 1xi9 n TYR 137 Ca 0.06 -0.82 0.00 0.00 -0.01 0.00 0.00 57.90 57.13 1xi9 n TYR 137 Cb 0.12 -0.47 0.00 0.00 -0.02 0.00 0.00 39.34 38.97 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 -0.05 0.43 3.82 2.72 0.00 -0.74 -4.24 105.19 107.14 1xi9 n GLY 138 Ca 0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.00 1.63 -0.26 -0.02 0.00 0.26 -0.39 107.32 106.53 1xi9 s GLY 139 Ca 0.00 -0.20 -0.05 0.00 0.00 0.00 0.00 44.72 44.47 1xi9 s GLY 139 CO 0.00 0.20 0.02 1.25 0.00 0.00 0.00 173.10 174.58 1xi9 s LYS 140 N -5.18 3.18 -0.25 2.90 2.20 0.94 -3.74 119.74 119.78 1xi9 s LYS 140 Ca 0.60 -0.78 -0.27 0.00 -0.36 0.00 0.00 55.97 55.16 1xi9 s LYS 140 Cb -0.14 -3.21 0.00 0.00 -1.51 0.00 0.00 37.83 32.98 1xi9 s LYS 140 CO 0.54 -0.35 0.95 -1.25 -0.36 0.00 0.00 175.35 174.88 1xi9 s PRO 141 N 1.48 4.19 -0.24 4.03 0.04 -1.26 -1.69 135.00 141.54 1xi9 s PRO 141 Ca 0.03 1.12 -0.06 0.00 0.04 0.00 0.00 61.00 62.13 1xi9 s PRO 141 Cb -0.16 -3.66 -0.02 0.00 0.04 0.00 0.00 34.50 30.70 1xi9 s PRO 141 CO -0.00 -0.62 0.02 0.08 0.04 0.00 0.00 177.00 176.52 1xi9 s VAL 142 N 3.10 3.88 -0.15 -0.36 1.01 0.46 -4.95 120.40 123.39 1xi9 s VAL 142 Ca 0.40 -0.33 -0.22 0.00 0.00 0.00 0.00 61.98 61.83 1xi9 s VAL 142 Cb -0.15 -2.80 -0.03 0.00 0.00 0.00 0.00 36.38 33.41 1xi9 s VAL 142 CO 0.08 0.37 0.67 -1.61 0.00 0.00 0.00 175.10 174.62 1xi9 s GLU 143 N 1.55 4.30 -0.01 2.72 2.02 -1.26 -0.51 118.70 127.52 1xi9 s GLU 143 Ca 0.06 0.75 -0.04 0.00 0.02 0.00 0.00 54.97 55.76 1xi9 s GLU 143 Cb -0.15 -3.53 -0.04 0.00 0.10 0.00 0.00 34.13 30.51 1xi9 s GLU 143 CO 0.00 -0.13 0.21 1.52 0.02 0.00 0.00 175.26 176.88 1xi9 s TYR 144 N 1.52 3.56 0.37 1.61 -0.85 -0.02 -4.86 117.35 118.67 1xi9 s TYR 144 Ca 0.33 0.44 -0.28 0.00 -0.52 0.00 0.00 57.07 57.04 1xi9 s TYR 144 Cb -0.16 -1.89 -0.10 0.00 0.38 0.00 0.00 41.96 40.19 1xi9 s TYR 144 CO 0.13 0.64 1.33 0.50 -1.52 0.00 0.00 175.55 176.63 1xi9 s ARG 145 N -1.84 4.17 0.12 -3.49 3.52 -1.26 -0.58 118.95 119.58 1xi9 s ARG 145 Ca 0.27 2.24 0.10 0.00 -0.13 0.00 0.00 55.73 58.21 1xi9 s ARG 145 Cb -0.13 -2.93 -0.04 0.00 -1.56 0.00 0.00 34.95 30.29 1xi9 s ARG 145 CO 0.17 -0.35 -0.25 0.95 -0.81 0.00 0.00 175.30 175.01 1xi9 s THR 146 N -1.18 2.07 -0.38 4.11 -4.23 -0.78 -0.63 115.64 114.63 1xi9 s THR 146 Ca 0.52 -1.67 -0.07 0.00 -1.18 0.00 0.00 61.69 59.30 1xi9 s THR 146 Cb -0.40 -1.84 0.07 0.00 1.34 0.00 0.00 72.50 71.66 1xi9 s THR 146 CO 0.53 0.06 0.17 -0.63 -0.54 0.00 0.00 174.62 174.20 1xi9 s ILE 147 N -1.08 3.82 0.23 2.99 1.01 -0.51 -4.84 121.20 122.83 1xi9 s ILE 147 Ca 0.11 -1.39 -0.07 0.00 0.00 0.00 0.00 60.65 59.31 1xi9 s ILE 147 Cb -0.10 -3.30 0.19 0.00 0.01 0.00 0.00 42.46 39.26 1xi9 s ILE 147 CO 0.05 -0.37 1.74 -0.08 0.00 0.00 0.00 174.94 176.28 1xi9 h GLU 148 N 8.25 0.42 -0.71 2.79 4.81 -1.92 0.32 114.58 128.55 1xi9 h GLU 148 Ca -0.21 -0.03 0.20 0.00 -0.13 0.00 0.00 59.36 59.20 1xi9 h GLU 148 Cb 1.08 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.33 1xi9 h GLU 148 CO 0.67 0.28 0.53 1.49 -0.73 0.00 0.00 179.01 181.25 1xi9 h GLU 149 N 0.43 0.00 -0.54 1.92 4.81 -1.99 -0.74 114.58 118.48 1xi9 h GLU 149 Ca 0.36 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.49 1xi9 h GLU 149 Cb 0.50 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.82 1xi9 h GLU 149 CO -0.36 0.00 0.11 0.39 -0.73 0.00 0.00 179.01 178.42 1xi9 n GLU 150 N -4.24 3.58 -3.34 1.92 1.02 0.02 -4.91 120.64 114.69 1xi9 n GLU 150 Ca 0.14 -3.05 -0.18 0.00 -0.02 0.00 0.00 57.16 54.04 1xi9 n GLU 150 Cb 0.79 -2.09 0.06 0.00 -0.02 0.00 0.00 31.44 30.19 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 -0.19 -5.03 -2.15 1.62 10.43 -0.28 -3.58 116.55 117.37 1xi9 n ASP 151 Ca 0.32 -0.44 -0.17 0.00 2.57 0.00 0.00 54.79 57.07 1xi9 n ASP 151 Cb 1.18 -4.12 0.01 0.00 1.84 0.00 0.00 41.12 40.03 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 -4.37 -1.11 -2.50 1.24 7.02 0.91 -4.60 117.44 114.03 1xi9 n TRP 152 Ca -0.02 0.16 -0.35 0.00 -1.02 0.00 0.00 57.50 56.27 1xi9 n TRP 152 Cb 0.56 -3.59 -0.03 0.00 -2.42 0.00 0.00 31.31 25.83 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 -5.09 3.81 0.52 -0.99 -1.52 -1.23 -4.44 119.66 110.72 1xi9 s GLN 153 Ca 0.09 1.44 -0.21 0.00 -1.95 0.00 0.00 55.36 54.73 1xi9 s GLN 153 Cb -0.04 -2.17 -0.07 0.00 -0.22 0.00 0.00 33.01 30.51 1xi9 s GLN 153 CO 0.12 -0.44 1.08 -2.30 -0.25 0.00 0.00 175.29 173.50 1xi9 n PRO 154 N -0.83 1.28 -2.97 2.91 -0.02 -1.26 -1.42 135.00 132.69 1xi9 n PRO 154 Ca 0.09 0.47 -0.44 0.00 -2.02 0.00 0.00 63.50 61.61 1xi9 n PRO 154 Cb 0.52 -2.23 -0.04 0.00 -0.02 0.00 0.00 33.50 31.72 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 -0.97 6.20 0.17 2.55 3.68 0.20 -4.79 116.67 123.72 1xi9 s ASP 155 Ca 0.70 -1.05 -0.14 0.00 2.13 0.00 0.00 52.55 54.19 1xi9 s ASP 155 Cb -0.46 -2.37 0.07 0.00 -1.45 0.00 0.00 42.92 38.71 1xi9 s ASP 155 CO 0.51 -1.26 1.82 0.40 0.13 0.00 0.00 175.17 176.78 1xi9 h ILE 156 N 5.95 1.09 -0.80 4.11 1.08 -1.92 -1.59 117.51 125.43 1xi9 h ILE 156 Ca -0.29 -0.22 0.04 0.00 -0.39 0.00 0.00 64.86 64.01 1xi9 h ILE 156 Cb 1.08 0.40 -0.05 0.00 -3.07 0.00 0.00 36.82 35.18 1xi9 h ILE 156 CO 1.12 0.12 0.53 0.44 -0.69 0.00 0.00 178.15 179.67 1xi9 h ASP 157 N 0.64 0.83 -0.39 1.72 3.45 -1.98 -1.39 116.42 119.29 1xi9 h ASP 157 Ca 0.19 -0.01 -0.16 0.00 0.43 0.00 0.00 57.03 57.49 1xi9 h ASP 157 Cb -0.03 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 38.55 1xi9 h ASP 157 CO -0.07 0.56 -0.37 -0.78 -1.57 0.00 0.00 179.24 177.02 1xi9 h ASP 158 N 0.96 1.01 -0.68 6.45 3.58 -1.81 -2.17 116.42 123.75 1xi9 h ASP 158 Ca 0.33 -0.46 0.03 0.00 0.42 0.00 0.00 57.03 57.35 1xi9 h ASP 158 Cb 0.09 -0.28 -0.04 0.00 1.72 0.00 0.00 39.33 40.81 1xi9 h ASP 158 CO -0.10 1.26 0.43 0.40 -2.88 0.00 0.00 179.24 178.35 1xi9 h ILE 159 N 0.78 1.10 -0.48 2.25 2.04 -0.66 -1.61 117.51 120.93 1xi9 h ILE 159 Ca 0.07 -0.29 0.03 0.00 1.00 0.00 0.00 64.86 65.67 1xi9 h ILE 159 Cb 0.97 0.18 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 1xi9 h ILE 159 CO 0.09 0.15 0.26 0.03 0.00 0.00 0.00 178.15 178.69 1xi9 h ARG 160 N 0.85 0.50 -0.01 2.37 3.08 -1.05 -2.60 114.38 117.52 1xi9 h ARG 160 Ca 0.27 -0.03 -0.14 0.00 0.07 0.00 0.00 59.98 60.15 1xi9 h ARG 160 Cb 0.00 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 1xi9 h ARG 160 CO -0.10 0.33 -0.67 0.87 -1.07 0.00 0.00 179.97 179.33 1xi9 h LYS 161 N 0.51 0.03 0.00 0.04 1.57 -1.24 -3.26 116.57 114.23 1xi9 h LYS 161 Ca 0.20 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1xi9 h LYS 161 Cb 0.08 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1xi9 h LYS 161 CO -0.12 0.69 -0.20 0.87 -0.57 0.00 0.00 179.45 180.12 1xi9 h LYS 162 N 0.02 0.00 -6.55 3.15 1.79 -1.06 -3.45 116.57 110.48 1xi9 h LYS 162 Ca -0.01 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 57.93 1xi9 h LYS 162 Cb 1.19 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 1xi9 h LYS 162 CO 0.09 0.00 0.50 -1.50 -1.08 0.00 0.00 179.45 177.46 1xi9 s ILE 163 N -3.13 4.06 0.45 1.86 2.07 -1.00 -5.02 121.20 120.48 1xi9 s ILE 163 Ca 0.09 1.59 0.03 0.00 -1.41 0.00 0.00 60.65 60.95 1xi9 s ILE 163 Cb 0.12 -4.02 -0.01 0.00 0.13 0.00 0.00 42.46 38.68 1xi9 s ILE 163 CO 0.64 0.19 0.11 0.42 -1.91 0.00 0.00 174.94 174.39 1xi9 s THR 164 N 0.52 0.62 -0.82 4.00 -4.23 -1.26 -5.03 115.64 109.44 1xi9 s THR 164 Ca 0.54 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 59.26 1xi9 s THR 164 Cb -0.28 -2.22 0.20 0.00 1.34 0.00 0.00 72.50 71.53 1xi9 s THR 164 CO 0.31 0.00 1.67 -0.90 -0.54 0.00 0.00 174.62 175.16 1xi9 n ASP 165 N -1.42 0.29 0.01 3.99 3.85 -1.26 -2.60 116.55 119.40 1xi9 n ASP 165 Ca -0.10 0.55 0.13 0.00 -0.71 0.00 0.00 54.79 54.66 1xi9 n ASP 165 Cb 0.65 -0.62 0.36 0.00 -1.35 0.00 0.00 41.12 40.16 1xi9 n ASP 165 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1xi9 n ARG 166 N -1.80 0.02 -2.19 0.11 5.12 -1.26 -4.91 116.66 111.75 1xi9 n ARG 166 Ca 0.04 0.01 -0.42 0.00 -1.93 0.00 0.00 57.85 55.55 1xi9 n ARG 166 Cb 0.25 -1.52 -0.03 0.00 -1.16 0.00 0.00 32.46 30.01 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 -3.01 3.50 -0.03 0.55 2.01 -1.07 -0.58 115.64 117.02 1xi9 s THR 167 Ca 0.12 1.00 0.14 0.00 0.31 0.00 0.00 61.69 63.26 1xi9 s THR 167 Cb 0.18 -3.64 -0.22 0.00 0.01 0.00 0.00 72.50 68.83 1xi9 s THR 167 CO 0.65 0.04 0.29 0.29 -0.69 0.00 0.00 174.62 175.20 1xi9 n LYS 168 N 4.66 0.51 -3.49 4.92 4.76 0.95 -4.86 118.16 125.61 1xi9 n LYS 168 Ca 0.12 -0.12 -0.10 0.00 -2.87 0.00 0.00 58.31 55.34 1xi9 n LYS 168 Cb 0.43 -1.34 -0.02 0.00 -1.84 0.00 0.00 35.03 32.26 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 -2.94 -1.71 -0.25 7.82 0.00 -1.25 -4.14 121.76 119.28 1xi9 s ALA 169 Ca -0.05 0.74 -0.03 0.00 0.00 0.00 0.00 51.96 52.62 1xi9 s ALA 169 Cb 0.09 0.63 0.02 0.00 0.00 0.00 0.00 23.12 23.86 1xi9 s ALA 169 CO 0.59 -0.74 -0.04 0.42 0.00 0.00 0.00 175.76 175.98 1xi9 s ILE 170 N -3.41 3.09 0.09 0.00 1.01 -1.07 -1.54 121.20 119.38 1xi9 s ILE 170 Ca 0.04 -0.90 -0.25 0.00 0.00 0.00 0.00 60.65 59.53 1xi9 s ILE 170 Cb -0.01 -2.55 -0.06 0.00 0.01 0.00 0.00 42.46 39.85 1xi9 s ILE 170 CO -0.10 0.22 0.77 0.00 0.00 0.00 0.00 174.94 175.83 1xi9 s ALA 171 N 1.37 3.40 -0.17 9.38 0.00 0.60 -1.44 121.76 134.89 1xi9 s ALA 171 Ca 0.01 0.32 0.01 0.00 0.00 0.00 0.00 51.96 52.30 1xi9 s ALA 171 Cb -0.16 -2.98 0.03 0.00 0.00 0.00 0.00 23.12 20.00 1xi9 s ALA 171 CO -0.03 0.15 -0.13 0.08 0.00 0.00 0.00 175.76 175.83 1xi9 s VAL 172 N -0.47 1.65 -0.41 0.00 1.01 0.92 -4.38 120.40 118.72 1xi9 s VAL 172 Ca 0.38 -0.83 -0.07 0.00 0.00 0.00 0.00 61.98 61.46 1xi9 s VAL 172 Cb -0.22 -1.62 0.09 0.00 0.00 0.00 0.00 36.38 34.63 1xi9 s VAL 172 CO 0.24 0.34 0.22 -0.63 0.00 0.00 0.00 175.10 175.27 1xi9 s ILE 173 N 1.43 3.81 -0.18 2.22 1.01 -1.26 -0.64 121.20 127.59 1xi9 s ILE 173 Ca 0.02 -1.63 -0.06 0.00 0.00 0.00 0.00 60.65 58.98 1xi9 s ILE 173 Cb -0.14 -3.42 0.08 0.00 0.01 0.00 0.00 42.46 38.99 1xi9 s ILE 173 CO -0.10 -0.55 0.37 0.21 0.00 0.00 0.00 174.94 174.88 1xi9 s ASN 174 N 2.00 -0.10 0.84 3.58 2.47 -1.06 -3.60 114.94 119.07 1xi9 s ASN 174 Ca 0.04 0.87 -0.13 0.00 0.42 0.00 0.00 52.86 54.06 1xi9 s ASN 174 Cb -0.23 1.13 0.09 0.00 -1.45 0.00 0.00 41.25 40.79 1xi9 s ASN 174 CO -0.00 -0.23 1.11 -2.65 -3.72 0.00 0.00 177.10 171.61 1xi9 n PRO 175 N 5.30 0.03 -3.79 0.43 -0.02 -1.26 -4.41 135.00 131.28 1xi9 n PRO 175 Ca -0.09 0.09 -0.37 0.00 -2.02 0.00 0.00 63.50 61.11 1xi9 n PRO 175 Cb 0.50 -2.36 -0.06 0.00 -0.02 0.00 0.00 33.50 31.55 1xi9 n PRO 175 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1xi9 s ASN 176 N -2.19 6.47 -0.18 2.55 3.84 -0.49 -4.72 114.94 120.22 1xi9 s ASN 176 Ca 0.71 0.56 -0.04 0.00 0.21 0.00 0.00 52.86 54.29 1xi9 s ASN 176 Cb -0.28 -2.11 -0.02 0.00 -0.55 0.00 0.00 41.25 38.29 1xi9 s ASN 176 CO 0.54 0.37 -0.03 0.21 -2.79 0.00 0.00 177.10 175.40 1xi9 s ASN 177 N -0.92 4.75 0.00 -4.21 3.84 -1.26 -0.90 114.94 116.23 1xi9 s ASN 177 Ca 0.16 -0.18 0.22 0.00 0.21 0.00 0.00 52.86 53.28 1xi9 s ASN 177 Cb -0.13 -1.79 0.51 0.00 -0.55 0.00 0.00 41.25 39.29 1xi9 s ASN 177 CO 0.06 0.12 1.45 -0.81 -2.79 0.00 0.00 177.10 175.12 1xi9 n PRO 178 N 3.88 2.43 0.08 0.43 -0.04 -1.26 -4.27 135.00 136.24 1xi9 n PRO 178 Ca -0.17 -2.17 0.11 0.00 -0.04 0.00 0.00 63.50 61.23 1xi9 n PRO 178 Cb 0.52 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.45 1xi9 n PRO 178 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1xi9 n THR 179 N 1.34 0.48 -1.12 0.52 -2.24 -1.24 -4.21 114.28 107.81 1xi9 n THR 179 Ca 0.20 -0.52 -0.04 0.00 -2.27 0.00 0.00 64.05 61.42 1xi9 n THR 179 Cb 0.56 -0.25 -0.02 0.00 -2.10 0.00 0.00 70.33 68.53 1xi9 n THR 179 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xi9 n GLY 180 N 1.21 0.66 3.76 3.38 0.00 -0.08 -4.48 105.19 109.63 1xi9 n GLY 180 Ca -0.01 -0.34 -0.37 0.00 0.00 0.00 0.00 46.02 45.30 1xi9 n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xi9 s ALA 181 N -1.96 2.75 -0.21 4.61 0.00 -1.26 0.14 121.76 125.82 1xi9 s ALA 181 Ca 0.00 1.03 0.02 0.00 0.00 0.00 0.00 51.96 53.01 1xi9 s ALA 181 Cb 0.00 -3.44 0.04 0.00 0.00 0.00 0.00 23.12 19.71 1xi9 s ALA 181 CO 0.00 -1.01 -0.16 -1.17 0.00 0.00 0.00 175.76 173.42 1xi9 s LEU 182 N -3.61 2.59 0.26 0.00 2.96 -1.26 -1.39 118.68 118.23 1xi9 s LEU 182 Ca 0.72 -0.92 -0.29 0.00 -0.22 0.00 0.00 54.13 53.41 1xi9 s LEU 182 Cb -0.31 -1.49 -0.09 0.00 0.50 0.00 0.00 46.19 44.80 1xi9 s LEU 182 CO 0.36 -0.07 0.99 -0.31 -1.32 0.00 0.00 176.35 176.00 1xi9 s TYR 183 N 1.23 3.82 0.63 5.38 4.12 -1.26 -5.00 117.35 126.27 1xi9 s TYR 183 Ca -0.00 1.83 -0.07 0.00 0.02 0.00 0.00 57.07 58.85 1xi9 s TYR 183 Cb -0.16 -3.08 0.02 0.00 -1.52 0.00 0.00 41.96 37.22 1xi9 s TYR 183 CO -0.10 0.09 0.96 0.16 0.02 0.00 0.00 175.55 176.68 1xi9 s ASP 184 N -1.13 5.48 0.27 2.29 1.47 -1.26 -4.69 116.67 119.10 1xi9 s ASP 184 Ca 0.43 0.79 0.00 0.00 1.18 0.00 0.00 52.55 54.96 1xi9 s ASP 184 Cb -0.27 -1.70 0.54 0.00 -0.34 0.00 0.00 42.92 41.14 1xi9 s ASP 184 CO 0.34 -1.18 1.80 0.50 0.68 0.00 0.00 175.17 177.31 1xi9 h LYS 185 N -0.33 0.78 0.34 2.11 3.64 -1.96 -2.10 116.57 119.05 1xi9 h LYS 185 Ca -0.45 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 58.88 1xi9 h LYS 185 Cb 1.26 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.89 1xi9 h LYS 185 CO 0.61 0.52 -0.28 -0.22 -2.27 0.00 0.00 179.45 177.81 1xi9 h LYS 186 N 0.80 -0.60 -0.56 1.90 3.64 -1.98 0.20 116.57 119.97 1xi9 h LYS 186 Ca 0.48 0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.90 1xi9 h LYS 186 Cb 0.58 0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.50 1xi9 h LYS 186 CO -0.31 -0.40 0.34 1.79 -2.27 0.00 0.00 179.45 178.60 1xi9 h THR 187 N -0.63 1.17 -0.66 1.00 1.35 -1.88 0.55 112.91 113.81 1xi9 h THR 187 Ca -0.02 -0.38 -0.06 0.00 -0.55 0.00 0.00 66.41 65.40 1xi9 h THR 187 Cb 0.55 0.41 -0.03 0.00 -1.73 0.00 0.00 68.15 67.35 1xi9 h THR 187 CO -0.02 0.17 0.19 -0.07 -0.25 0.00 0.00 175.52 175.54 1xi9 h LEU 188 N 0.76 0.98 -1.15 3.87 3.38 -1.25 -1.22 115.31 120.68 1xi9 h LEU 188 Ca 0.20 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1xi9 h LEU 188 Cb -0.01 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 1xi9 h LEU 188 CO -0.04 0.94 0.33 -0.08 0.09 0.00 0.00 178.44 179.68 1xi9 h GLU 189 N 0.96 0.92 0.02 1.13 4.57 -0.23 -2.15 114.58 119.80 1xi9 h GLU 189 Ca 0.21 -0.11 -0.21 0.00 -1.18 0.00 0.00 59.36 58.07 1xi9 h GLU 189 Cb 0.33 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.73 1xi9 h GLU 189 CO -0.00 0.70 -0.95 0.93 -1.18 0.00 0.00 179.01 178.51 1xi9 h GLU 190 N 0.92 0.19 -0.43 1.92 5.08 -0.38 -2.40 114.58 119.48 1xi9 h GLU 190 Ca 0.23 -0.24 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 1xi9 h GLU 190 Cb 0.07 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 1xi9 h GLU 190 CO -0.03 1.00 -0.17 0.82 -1.00 0.00 0.00 179.01 179.63 1xi9 h ILE 191 N 0.10 1.27 -0.52 3.13 2.04 -1.13 -2.16 117.51 120.24 1xi9 h ILE 191 Ca -0.05 -1.28 -0.02 0.00 1.00 0.00 0.00 64.86 64.51 1xi9 h ILE 191 Cb 1.60 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 38.78 1xi9 h ILE 191 CO 0.14 0.43 0.25 -0.07 0.00 0.00 0.00 178.15 178.91 1xi9 h LEU 192 N 0.72 0.68 -0.79 1.44 3.38 -1.34 -0.17 115.31 119.23 1xi9 h LEU 192 Ca 0.11 -0.13 0.07 0.00 0.09 0.00 0.00 57.88 58.02 1xi9 h LEU 192 Cb 0.68 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.20 1xi9 h LEU 192 CO 0.05 0.62 0.46 0.78 0.09 0.00 0.00 178.44 180.44 1xi9 h ASN 193 N 0.69 0.70 -0.03 -0.43 2.35 -1.28 0.12 115.58 117.70 1xi9 h ASN 193 Ca 0.18 0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.95 1xi9 h ASN 193 Cb 0.12 -0.11 -0.00 0.00 0.05 0.00 0.00 38.32 38.38 1xi9 h ASN 193 CO -0.02 0.44 -0.01 0.40 -1.65 0.00 0.00 177.43 176.58 1xi9 h ILE 194 N 0.83 1.33 -0.88 2.81 2.04 -1.20 -1.66 117.51 120.79 1xi9 h ILE 194 Ca 0.35 -1.01 0.05 0.00 1.00 0.00 0.00 64.86 65.25 1xi9 h ILE 194 Cb 0.22 1.95 -0.06 0.00 -0.74 0.00 0.00 36.82 38.20 1xi9 h ILE 194 CO -0.19 0.27 0.56 0.00 0.00 0.00 0.00 178.15 178.79 1xi9 h ALA 195 N 0.60 1.18 -0.22 1.87 0.00 -0.85 -2.36 119.26 119.48 1xi9 h ALA 195 Ca 0.01 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1xi9 h ALA 195 Cb 0.44 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1xi9 h ALA 195 CO 0.00 0.37 0.14 0.78 0.00 0.00 0.00 179.25 180.54 1xi9 h GLY 196 N 1.06 0.31 0.24 0.00 0.00 -0.74 0.22 103.07 104.16 1xi9 h GLY 196 Ca 0.36 -0.11 0.13 0.00 0.00 0.00 0.00 47.33 47.72 1xi9 h GLY 196 CO -0.14 0.10 0.34 -2.09 0.00 0.00 0.00 176.54 174.75 1xi9 h GLU 197 N 0.28 0.50 -0.18 4.80 4.81 -0.94 -2.24 114.58 121.61 1xi9 h GLU 197 Ca 0.08 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1xi9 h GLU 197 Cb -0.02 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.25 1xi9 h GLU 197 CO -0.03 0.33 0.00 0.66 -0.73 0.00 0.00 179.01 179.24 1xi9 n TYR 198 N -4.94 0.22 -3.73 0.92 4.02 -0.92 -4.98 117.16 107.75 1xi9 n TYR 198 Ca 0.14 -0.11 -0.24 0.00 -0.01 0.00 0.00 57.90 57.68 1xi9 n TYR 198 Cb 0.39 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.75 1xi9 n TYR 198 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1xi9 n GLU 199 N 1.11 -5.71 -4.32 -0.72 1.02 -0.05 -5.03 120.64 106.94 1xi9 n GLU 199 Ca 0.17 0.66 -0.28 0.00 -0.02 0.00 0.00 57.16 57.70 1xi9 n GLU 199 Cb 0.53 -5.45 -0.10 0.00 -0.02 0.00 0.00 31.44 26.40 1xi9 n GLU 199 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1xi9 s ILE 200 N -3.47 2.94 0.83 -3.67 -4.36 -0.50 -5.03 121.20 107.94 1xi9 s ILE 200 Ca 0.30 -1.68 -0.11 0.00 -0.26 0.00 0.00 60.65 58.90 1xi9 s ILE 200 Cb -0.15 -2.42 0.09 0.00 1.25 0.00 0.00 42.46 41.23 1xi9 s ILE 200 CO 0.80 -0.05 1.09 -2.16 0.24 0.00 0.00 174.94 174.86 1xi9 s PRO 201 N -2.59 1.85 -0.10 0.37 0.04 -1.26 -4.55 135.00 128.75 1xi9 s PRO 201 Ca 0.22 0.78 -0.01 0.00 0.04 0.00 0.00 61.00 62.03 1xi9 s PRO 201 Cb -0.09 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.54 1xi9 s PRO 201 CO 0.13 -1.82 -0.04 0.08 0.04 0.00 0.00 177.00 175.38 1xi9 s VAL 202 N -3.04 3.89 -0.21 -0.36 1.01 -0.44 -2.61 120.40 118.64 1xi9 s VAL 202 Ca 0.62 -0.39 -0.06 0.00 0.00 0.00 0.00 61.98 62.15 1xi9 s VAL 202 Cb -0.16 -2.64 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 1xi9 s VAL 202 CO 0.55 0.56 0.03 -0.63 0.00 0.00 0.00 175.10 175.61 1xi9 s ILE 203 N -0.41 4.17 -0.24 2.22 1.01 -0.52 -0.23 121.20 127.20 1xi9 s ILE 203 Ca 0.06 -0.24 0.01 0.00 0.00 0.00 0.00 60.65 60.49 1xi9 s ILE 203 Cb -0.12 -2.90 0.04 0.00 0.01 0.00 0.00 42.46 39.49 1xi9 s ILE 203 CO 0.02 0.41 -0.12 -0.55 0.00 0.00 0.00 174.94 174.71 1xi9 s SER 204 N 1.03 4.12 -0.49 3.58 0.15 0.18 -0.06 113.70 122.21 1xi9 s SER 204 Ca 0.03 -1.09 -0.20 0.00 0.70 0.00 0.00 55.95 55.38 1xi9 s SER 204 Cb -0.14 -1.57 0.05 0.00 -1.71 0.00 0.00 66.02 62.65 1xi9 s SER 204 CO 0.02 -0.13 0.67 -0.62 1.20 0.00 0.00 173.24 174.37 1xi9 s ASP 205 N 1.20 6.26 -0.16 5.45 -1.08 0.19 -0.60 116.67 127.94 1xi9 s ASP 205 Ca -0.03 -0.68 0.18 0.00 -0.52 0.00 0.00 52.55 51.50 1xi9 s ASP 205 Cb -0.18 -2.31 0.40 0.00 -1.46 0.00 0.00 42.92 39.37 1xi9 s ASP 205 CO -0.07 -0.90 1.28 -0.62 0.52 0.00 0.00 175.17 175.39 1xi9 n GLU 206 N 6.35 2.02 -0.37 4.34 1.02 -0.36 -2.58 120.64 131.06 1xi9 n GLU 206 Ca -0.04 -2.73 0.29 0.00 -0.02 0.00 0.00 57.16 54.66 1xi9 n GLU 206 Cb 0.46 -1.66 0.57 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 0.84 0.34 -0.02 -3.67 6.09 -1.87 0.56 117.51 119.78 1xi9 h ILE 207 Ca 0.01 -0.08 0.00 0.00 -1.37 0.00 0.00 64.86 63.41 1xi9 h ILE 207 Cb 1.22 0.07 0.00 0.00 0.47 0.00 0.00 36.82 38.57 1xi9 h ILE 207 CO 0.11 0.05 -0.04 -1.22 -3.07 0.00 0.00 178.15 173.97 1xi9 n TYR 208 N -4.67 0.00 0.00 2.19 4.01 -1.26 -4.03 117.16 113.40 1xi9 n TYR 208 Ca 0.31 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.05 1xi9 n TYR 208 Cb 1.13 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 40.15 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 0.66 0.00 -0.60 7.72 2.03 0.19 -0.52 116.55 126.03 1xi9 n ASP 209 Ca 0.16 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.60 1xi9 n ASP 209 Cb 0.47 0.00 0.42 0.00 -0.72 0.00 0.00 41.12 41.29 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 0.00 1.87 -3.60 -2.67 4.77 -1.26 -4.57 117.00 111.54 1xi9 n LEU 210 Ca 0.00 -0.65 -0.41 0.00 -0.03 0.00 0.00 56.01 54.92 1xi9 n LEU 210 Cb 0.00 -0.02 -0.00 0.00 -2.33 0.00 0.00 43.42 41.07 1xi9 n LEU 210 CO 0.00 0.33 2.38 0.80 -1.33 0.00 0.00 177.39 179.57 1xi9 n MET 211 N 0.46 4.07 -4.32 3.23 1.56 0.32 -4.94 117.12 117.51 1xi9 n MET 211 Ca 0.18 -3.30 -0.24 0.00 -0.27 0.00 0.00 57.70 54.07 1xi9 n MET 211 Cb 0.41 -2.79 -0.12 0.00 2.15 0.00 0.00 33.22 32.87 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 -0.03 1.84 -0.05 1.12 -4.23 -1.26 -0.90 115.64 112.14 1xi9 s THR 212 Ca 0.50 -1.72 -0.06 0.00 -1.18 0.00 0.00 61.69 59.23 1xi9 s THR 212 Cb 0.15 -1.73 -0.02 0.00 1.34 0.00 0.00 72.50 72.24 1xi9 s THR 212 CO -0.06 -0.14 -0.11 -1.22 -0.54 0.00 0.00 174.62 172.56 1xi9 n TYR 213 N 0.74 0.00 -4.17 3.99 4.02 -0.83 -4.97 117.16 115.94 1xi9 n TYR 213 Ca -0.17 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.43 1xi9 n TYR 213 Cb 0.55 -0.16 -0.08 0.00 -0.02 0.00 0.00 39.34 39.63 1xi9 n TYR 213 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 1xi9 s GLU 214 N -1.69 2.43 0.00 -0.72 8.01 -1.26 -5.05 118.70 120.42 1xi9 s GLU 214 Ca -0.09 -0.96 0.00 0.00 0.01 0.00 0.00 54.97 53.93 1xi9 s GLU 214 Cb 0.01 -2.44 0.00 0.00 -4.31 0.00 0.00 34.13 27.39 1xi9 s GLU 214 CO 0.14 0.50 0.00 0.41 0.01 0.00 0.00 175.26 176.32 1xi9 n GLY 215 N 0.34 -1.71 3.28 -1.39 0.00 -1.26 -4.90 105.19 99.55 1xi9 n GLY 215 Ca -0.11 -1.54 -0.25 0.00 0.00 0.00 0.00 46.02 44.12 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 -2.62 1.29 0.14 1.61 0.41 -1.26 -4.90 118.70 113.37 1xi9 s GLU 216 Ca 0.00 -1.07 -0.30 0.00 -0.41 0.00 0.00 54.97 53.19 1xi9 s GLU 216 Cb 0.00 -1.50 -0.07 0.00 -1.78 0.00 0.00 34.13 30.78 1xi9 s GLU 216 CO 0.00 0.37 1.05 -1.58 -0.49 0.00 0.00 175.26 174.61 1xi9 s HIS 217 N -0.98 3.67 -0.10 1.61 5.65 -1.26 -4.98 115.29 118.90 1xi9 s HIS 217 Ca 0.08 1.65 0.04 0.00 0.25 0.00 0.00 55.06 57.08 1xi9 s HIS 217 Cb -0.09 -3.20 -0.00 0.00 -1.18 0.00 0.00 32.58 28.11 1xi9 s HIS 217 CO 0.03 -0.34 -0.23 0.42 -0.65 0.00 0.00 174.74 173.97 1xi9 s ILE 218 N -0.02 2.14 0.09 0.89 1.01 -1.26 -5.10 121.20 118.94 1xi9 s ILE 218 Ca 0.49 -0.99 -0.25 0.00 0.00 0.00 0.00 60.65 59.90 1xi9 s ILE 218 Cb -0.27 -1.82 -0.06 0.00 0.01 0.00 0.00 42.46 40.32 1xi9 s ILE 218 CO 0.32 0.56 0.78 -0.55 0.00 0.00 0.00 174.94 176.05 1xi9 s SER 219 N 0.33 7.28 0.55 3.58 0.15 -1.26 -4.95 113.70 119.38 1xi9 s SER 219 Ca -0.18 1.53 0.23 0.00 0.70 0.00 0.00 55.95 58.22 1xi9 s SER 219 Cb -0.18 -2.48 1.48 0.00 -1.71 0.00 0.00 66.02 63.13 1xi9 s SER 219 CO 0.09 0.07 2.14 -0.65 1.20 0.00 0.00 173.24 176.09 1xi9 h PRO 220 N 5.24 0.00 -0.89 5.44 0.11 -1.99 -1.53 132.00 138.38 1xi9 h PRO 220 Ca -0.45 0.00 0.12 0.00 0.11 0.00 0.00 66.00 65.78 1xi9 h PRO 220 Cb 1.21 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.25 1xi9 h PRO 220 CO 0.69 0.00 0.57 0.78 -0.21 0.00 0.00 178.00 179.83 1xi9 h GLY 221 N 0.00 1.25 2.00 -0.55 0.00 -1.94 0.56 103.07 104.39 1xi9 h GLY 221 Ca 0.05 -0.34 -0.05 0.00 0.00 0.00 0.00 47.33 47.00 1xi9 h GLY 221 CO -0.00 0.16 -0.23 1.76 0.00 0.00 0.00 176.54 178.23 1xi9 h SER 222 N 0.80 0.00 0.00 0.19 0.02 -1.48 -3.34 113.55 109.74 1xi9 h SER 222 Ca 0.43 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.30 1xi9 h SER 222 Cb 0.53 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 1xi9 h SER 222 CO -0.19 0.23 -1.95 0.18 -1.14 0.00 0.00 176.83 173.95 1xi9 n LEU 223 N -3.83 0.00 -4.75 5.07 4.77 0.04 -5.01 117.00 113.29 1xi9 n LEU 223 Ca -0.02 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.60 1xi9 n LEU 223 Cb 0.32 0.11 0.03 0.00 -2.33 0.00 0.00 43.42 41.55 1xi9 n LEU 223 CO 0.34 0.11 0.88 0.28 -1.33 0.00 0.00 177.39 177.67 1xi9 s THR 224 N -3.10 2.51 -0.02 -5.08 -1.32 -0.31 -4.98 115.64 103.34 1xi9 s THR 224 Ca -0.07 0.34 -0.06 0.00 -1.21 0.00 0.00 61.69 60.69 1xi9 s THR 224 Cb 0.10 -3.15 -0.02 0.00 -1.51 0.00 0.00 72.50 67.92 1xi9 s THR 224 CO 0.77 -0.05 -0.11 0.29 -2.21 0.00 0.00 174.62 173.32 1xi9 n LYS 225 N -1.33 0.17 -0.01 7.08 4.76 -1.26 -4.89 118.16 122.68 1xi9 n LYS 225 Ca 0.12 0.07 0.08 0.00 -2.87 0.00 0.00 58.31 55.71 1xi9 n LYS 225 Cb 0.48 -0.72 -0.14 0.00 -1.84 0.00 0.00 35.03 32.81 1xi9 n LYS 225 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1xi9 n ASP 226 N -3.51 0.83 -4.68 4.39 9.92 -1.26 -4.99 116.55 117.24 1xi9 n ASP 226 Ca -0.04 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 53.79 1xi9 n ASP 226 Cb 0.17 1.79 -0.03 0.00 -0.64 0.00 0.00 41.12 42.41 1xi9 n ASP 226 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1xi9 s VAL 227 N -3.23 4.80 0.10 2.53 1.01 -1.26 -5.00 120.40 119.35 1xi9 s VAL 227 Ca -0.07 1.91 -0.31 0.00 0.00 0.00 0.00 61.98 63.52 1xi9 s VAL 227 Cb 0.11 -4.26 -0.08 0.00 0.00 0.00 0.00 36.38 32.16 1xi9 s VAL 227 CO 0.76 -0.01 1.41 -2.16 0.00 0.00 0.00 175.10 175.10 1xi9 s PRO 228 N 2.17 4.30 -0.10 2.72 0.04 -1.26 -4.87 135.00 138.00 1xi9 s PRO 228 Ca 0.45 2.09 0.03 0.00 0.04 0.00 0.00 61.00 63.60 1xi9 s PRO 228 Cb -0.17 -3.31 0.01 0.00 0.04 0.00 0.00 34.50 31.06 1xi9 s PRO 228 CO 0.15 -0.48 -0.20 0.08 0.04 0.00 0.00 177.00 176.59 1xi9 s VAL 229 N 1.38 1.76 -0.28 -0.36 1.01 -0.21 -1.33 120.40 122.37 1xi9 s VAL 229 Ca 0.65 -0.84 -0.08 0.00 0.00 0.00 0.00 61.98 61.72 1xi9 s VAL 229 Cb -0.37 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.45 1xi9 s VAL 229 CO 0.30 0.49 0.10 -0.63 0.00 0.00 0.00 175.10 175.36 1xi9 s ILE 230 N 0.54 4.30 -0.13 2.22 1.01 0.68 -0.39 121.20 129.43 1xi9 s ILE 230 Ca -0.15 -0.42 -0.05 0.00 0.00 0.00 0.00 60.65 60.02 1xi9 s ILE 230 Cb -0.17 -3.14 -0.04 0.00 0.01 0.00 0.00 42.46 39.13 1xi9 s ILE 230 CO 0.05 0.16 0.06 -0.69 0.00 0.00 0.00 174.94 174.52 1xi9 s VAL 231 N 1.58 4.77 0.00 2.92 1.01 -0.58 0.49 120.40 130.59 1xi9 s VAL 231 Ca 0.05 -0.06 0.07 0.00 0.00 0.00 0.00 61.98 62.03 1xi9 s VAL 231 Cb -0.16 -3.08 -0.02 0.00 0.00 0.00 0.00 36.38 33.12 1xi9 s VAL 231 CO 0.04 0.55 -0.21 -0.04 0.00 0.00 0.00 175.10 175.44 1xi9 s MET 232 N -0.42 1.64 0.24 2.72 -1.94 0.23 -0.92 119.30 120.85 1xi9 s MET 232 Ca 0.09 -0.82 -0.08 0.00 -1.71 0.00 0.00 55.69 53.17 1xi9 s MET 232 Cb -0.12 -1.64 0.03 0.00 2.01 0.00 0.00 34.83 35.11 1xi9 s MET 232 CO 0.02 0.44 0.46 -1.71 -0.01 0.00 0.00 175.02 174.22 1xi9 n ASN 233 N 2.34 -1.35 0.00 3.03 2.85 -0.23 -1.22 115.26 120.69 1xi9 n ASN 233 Ca -0.16 -2.00 0.00 0.00 -0.11 0.00 0.00 54.58 52.31 1xi9 n ASN 233 Cb 0.53 2.26 0.00 0.00 1.24 0.00 0.00 39.78 43.81 1xi9 n ASN 233 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1xi9 n GLY 234 N -0.33 -0.72 0.03 8.20 0.00 -1.26 -0.84 105.19 110.27 1xi9 n GLY 234 Ca -0.05 -0.88 0.11 0.00 0.00 0.00 0.00 46.02 45.20 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 0.63 -0.33 0.99 4.77 -0.63 -4.54 117.00 117.88 1xi9 n LEU 235 Ca 0.00 -0.05 -0.02 0.00 -0.03 0.00 0.00 56.01 55.92 1xi9 n LEU 235 Cb 0.00 -0.11 0.13 0.00 -2.33 0.00 0.00 43.42 41.11 1xi9 n LEU 235 CO 0.00 0.07 1.26 0.28 -1.33 0.00 0.00 177.39 177.66 1xi9 h SER 236 N 0.00 1.09 0.00 -1.43 0.02 -1.75 -2.45 113.55 109.03 1xi9 h SER 236 Ca 0.00 -0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 60.87 1xi9 h SER 236 Cb 0.68 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 62.94 1xi9 h SER 236 CO 0.00 0.81 -0.78 0.29 -1.14 0.00 0.00 176.83 176.01 1xi9 n LYS 237 N -4.38 0.34 0.24 3.45 4.76 -1.26 -2.73 118.16 118.59 1xi9 n LYS 237 Ca 0.11 0.14 0.09 0.00 -2.87 0.00 0.00 58.31 55.77 1xi9 n LYS 237 Cb 0.04 -1.10 0.61 0.00 -1.84 0.00 0.00 35.03 32.74 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 -0.64 0.89 -0.17 -0.18 2.07 -1.75 -2.63 116.25 113.83 1xi9 h VAL 238 Ca -0.05 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 66.91 1xi9 h VAL 238 Cb 0.72 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 1xi9 h VAL 238 CO -0.03 0.15 0.00 -1.22 0.02 0.00 0.00 177.57 176.49 1xi9 n TYR 239 N -4.04 0.22 -3.93 1.57 4.01 -1.14 -4.94 117.16 108.91 1xi9 n TYR 239 Ca -0.02 -0.24 -0.28 0.00 -0.16 0.00 0.00 57.90 57.19 1xi9 n TYR 239 Cb 0.23 -0.01 0.01 0.00 -0.31 0.00 0.00 39.34 39.26 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 0.57 -2.00 -2.77 -0.72 3.72 -0.99 -4.13 117.46 111.14 1xi9 n PHE 240 Ca 0.09 0.84 -0.21 0.00 -0.05 0.00 0.00 57.45 58.12 1xi9 n PHE 240 Cb 0.35 -3.85 -0.01 0.00 -0.94 0.00 0.00 39.48 35.03 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 -4.49 4.05 -0.30 4.37 0.00 -0.94 -2.75 120.51 120.45 1xi9 n ALA 241 Ca -0.09 -4.00 0.01 0.00 0.00 0.00 0.00 53.44 49.35 1xi9 n ALA 241 Cb 0.58 -0.75 0.14 0.00 0.00 0.00 0.00 19.45 19.42 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 2.50 1.03 0.00 0.00 1.35 -1.77 -2.39 112.91 113.63 1xi9 h THR 242 Ca 0.13 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 1xi9 h THR 242 Cb 0.88 0.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.30 1xi9 h THR 242 CO 0.70 0.17 0.00 0.61 -0.25 0.00 0.00 175.52 176.75 1xi9 n GLY 243 N -1.32 -1.09 0.14 5.82 0.00 -1.26 -3.45 105.19 104.03 1xi9 n GLY 243 Ca 0.12 -0.18 0.10 0.00 0.00 0.00 0.00 46.02 46.06 1xi9 n GLY 243 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1xi9 h TRP 244 N 0.00 0.00 -5.75 1.61 6.55 -1.84 -3.49 115.95 113.04 1xi9 h TRP 244 Ca 0.00 0.00 -0.34 0.00 0.95 0.00 0.00 58.89 59.50 1xi9 h TRP 244 Cb 0.09 0.00 0.14 0.00 -0.86 0.00 0.00 29.16 28.54 1xi9 h TRP 244 CO 0.00 0.10 -0.82 0.54 -1.05 0.00 0.00 178.44 177.22 1xi9 n ARG 245 N -2.86 -4.89 -4.46 0.49 5.12 -1.22 -4.92 116.66 103.91 1xi9 n ARG 245 Ca 0.00 0.77 -0.22 0.00 -1.93 0.00 0.00 57.85 56.47 1xi9 n ARG 245 Cb 0.59 -5.58 -0.16 0.00 -1.16 0.00 0.00 32.46 26.15 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 -6.23 1.69 0.00 0.55 2.96 -1.26 -2.59 118.68 113.80 1xi9 s LEU 246 Ca 0.13 -0.23 0.00 0.00 -0.22 0.00 0.00 54.13 53.81 1xi9 s LEU 246 Cb -0.02 -0.66 0.00 0.00 0.50 0.00 0.00 46.19 46.01 1xi9 s LEU 246 CO 0.76 0.05 0.00 0.61 -1.32 0.00 0.00 176.35 176.45 1xi9 n GLY 247 N 3.53 3.25 3.55 7.98 0.00 -0.61 -1.61 105.19 121.27 1xi9 n GLY 247 Ca -0.21 -0.85 -0.07 0.00 0.00 0.00 0.00 46.02 44.89 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 -2.92 -0.30 0.17 1.61 1.13 -0.02 -1.81 117.35 115.21 1xi9 s TYR 248 Ca 0.00 0.14 0.06 0.00 -1.41 0.00 0.00 57.07 55.86 1xi9 s TYR 248 Cb 0.00 0.55 -0.04 0.00 -1.10 0.00 0.00 41.96 41.37 1xi9 s TYR 248 CO 0.00 -0.56 -0.12 0.00 -2.51 0.00 0.00 175.55 172.37 1xi9 s MET 249 N -3.08 1.16 0.21 -3.49 0.23 0.43 -1.06 119.30 113.69 1xi9 s MET 249 Ca 0.06 -1.49 -0.13 0.00 -1.03 0.00 0.00 55.69 53.10 1xi9 s MET 249 Cb -0.01 -0.82 0.00 0.00 -1.53 0.00 0.00 34.83 32.48 1xi9 s MET 249 CO -0.07 0.12 0.44 1.52 -2.03 0.00 0.00 175.02 175.00 1xi9 s TYR 250 N -3.14 0.25 -0.15 3.16 -0.85 -0.10 -0.75 117.35 115.78 1xi9 s TYR 250 Ca 0.18 -0.61 0.01 0.00 -0.52 0.00 0.00 57.07 56.14 1xi9 s TYR 250 Cb 0.01 0.18 0.01 0.00 0.38 0.00 0.00 41.96 42.53 1xi9 s TYR 250 CO 0.03 -0.91 -0.19 -0.06 -1.52 0.00 0.00 175.55 172.90 1xi9 s PHE 251 N -3.97 2.72 -0.66 -3.49 0.08 -0.40 -1.53 117.98 110.74 1xi9 s PHE 251 Ca 0.18 -1.23 -0.13 0.00 0.12 0.00 0.00 56.93 55.87 1xi9 s PHE 251 Cb 0.00 -1.85 0.17 0.00 -0.57 0.00 0.00 43.02 40.77 1xi9 s PHE 251 CO 0.04 -0.57 0.59 0.08 -0.10 0.00 0.00 175.22 175.26 1xi9 s VAL 252 N 0.84 5.12 -0.44 -0.44 1.01 0.47 -4.87 120.40 122.08 1xi9 s VAL 252 Ca -0.06 -2.08 0.05 0.00 0.00 0.00 0.00 61.98 59.89 1xi9 s VAL 252 Cb -0.15 -4.24 0.27 0.00 0.00 0.00 0.00 36.38 32.26 1xi9 s VAL 252 CO -0.02 -0.93 1.04 -0.67 0.00 0.00 0.00 175.10 174.53 1xi9 n ASP 253 N 4.50 -2.39 0.02 3.32 2.03 -1.26 -1.04 116.55 121.73 1xi9 n ASP 253 Ca 0.01 -3.06 0.03 0.00 0.52 0.00 0.00 54.79 52.28 1xi9 n ASP 253 Cb 0.43 1.64 0.39 0.00 -0.72 0.00 0.00 41.12 42.85 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 3.47 0.49 -0.03 -0.67 0.13 -1.96 -1.91 132.00 131.53 1xi9 h PRO 254 Ca -0.16 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 1xi9 h PRO 254 Cb 1.09 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.12 1xi9 h PRO 254 CO 0.17 0.41 0.00 0.39 -0.23 0.00 0.00 178.00 178.74 1xi9 n GLU 255 N -4.40 1.21 -3.34 0.86 1.02 -1.26 -4.92 120.64 109.81 1xi9 n GLU 255 Ca 0.02 -0.31 -0.24 0.00 -0.02 0.00 0.00 57.16 56.61 1xi9 n GLU 255 Cb 0.14 -1.38 0.01 0.00 -0.02 0.00 0.00 31.44 30.19 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 -0.52 -4.61 -0.02 1.62 3.02 -0.72 -4.88 115.26 109.15 1xi9 n ASN 256 Ca 0.17 -0.41 0.18 0.00 -0.03 0.00 0.00 54.58 54.49 1xi9 n ASN 256 Cb 0.16 -3.76 0.64 0.00 -0.61 0.00 0.00 39.78 36.21 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 -1.26 0.11 -0.69 3.52 6.56 -1.91 -1.76 116.57 121.13 1xi9 h LYS 257 Ca -0.48 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.10 1xi9 h LYS 257 Cb 1.32 -0.02 0.00 0.00 -0.57 0.00 0.00 32.23 32.96 1xi9 h LYS 257 CO 0.56 0.07 0.00 1.28 -2.06 0.00 0.00 179.45 179.30 1xi9 n LEU 258 N -4.41 4.42 -0.20 2.94 4.77 -1.26 -4.70 117.00 118.56 1xi9 n LEU 258 Ca 0.10 -2.24 -0.00 0.00 -0.03 0.00 0.00 56.01 53.83 1xi9 n LEU 258 Cb 0.54 -0.63 0.10 0.00 -2.33 0.00 0.00 43.42 41.10 1xi9 n LEU 258 CO 0.36 0.53 0.98 0.77 -1.33 0.00 0.00 177.39 178.70 1xi9 h SER 259 N 2.93 0.20 -0.39 -1.43 4.64 -1.70 0.70 113.55 118.50 1xi9 h SER 259 Ca 0.00 0.08 -0.10 0.00 -0.47 0.00 0.00 61.79 61.30 1xi9 h SER 259 Cb 1.56 0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 63.70 1xi9 h SER 259 CO 0.35 0.12 -0.14 -0.08 -0.87 0.00 0.00 176.83 176.21 1xi9 h GLU 260 N 0.39 0.79 -0.16 4.77 4.81 -1.85 0.93 114.58 124.26 1xi9 h GLU 260 Ca 0.30 -0.32 -0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1xi9 h GLU 260 Cb 0.38 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 1xi9 h GLU 260 CO -0.31 0.94 0.09 0.28 -0.73 0.00 0.00 179.01 179.28 1xi9 h VAL 261 N 0.60 1.09 -0.63 0.32 2.07 -1.70 -0.16 116.25 117.83 1xi9 h VAL 261 Ca 0.09 -0.22 0.03 0.00 0.82 0.00 0.00 66.70 67.42 1xi9 h VAL 261 Cb 0.67 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 1xi9 h VAL 261 CO 0.05 0.08 0.39 0.03 0.02 0.00 0.00 177.57 178.13 1xi9 h ARG 262 N 0.17 0.74 -0.80 1.57 3.08 0.51 -0.22 114.38 119.43 1xi9 h ARG 262 Ca 0.06 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 1xi9 h ARG 262 Cb 0.05 -0.17 -0.04 0.00 0.08 0.00 0.00 29.97 29.90 1xi9 h ARG 262 CO -0.01 0.49 0.33 1.49 -1.07 0.00 0.00 179.97 181.20 1xi9 h GLU 263 N 0.76 1.19 -0.51 0.04 4.81 -0.65 -2.04 114.58 118.17 1xi9 h GLU 263 Ca 0.26 -0.21 -0.04 0.00 -0.13 0.00 0.00 59.36 59.23 1xi9 h GLU 263 Cb 0.03 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.19 1xi9 h GLU 263 CO -0.11 0.95 0.15 0.00 -0.73 0.00 0.00 179.01 179.27 1xi9 h ALA 264 N 1.18 0.67 -0.69 2.92 0.00 -0.57 -2.55 119.26 120.23 1xi9 h ALA 264 Ca 0.27 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 55.03 1xi9 h ALA 264 Cb 0.20 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 1xi9 h ALA 264 CO -0.02 0.34 0.40 0.82 0.00 0.00 0.00 179.25 180.79 1xi9 h ILE 265 N 0.70 1.00 -0.55 0.00 2.04 -0.70 -2.23 117.51 117.78 1xi9 h ILE 265 Ca 0.16 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 1xi9 h ILE 265 Cb 0.30 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 1xi9 h ILE 265 CO -0.00 0.14 0.32 0.44 0.00 0.00 0.00 178.15 179.05 1xi9 h ASP 266 N 0.74 0.68 -0.54 1.72 3.45 -1.25 0.29 116.42 121.51 1xi9 h ASP 266 Ca 0.30 -0.07 0.07 0.00 0.43 0.00 0.00 57.03 57.75 1xi9 h ASP 266 Cb 0.15 -0.17 -0.06 0.00 -0.56 0.00 0.00 39.33 38.69 1xi9 h ASP 266 CO -0.16 0.55 0.23 0.03 -1.57 0.00 0.00 179.24 178.31 1xi9 h ARG 267 N 0.75 0.42 -0.31 3.56 3.08 -1.20 -0.71 114.38 119.96 1xi9 h ARG 267 Ca 0.20 -0.03 -0.11 0.00 0.07 0.00 0.00 59.98 60.11 1xi9 h ARG 267 Cb 0.01 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 1xi9 h ARG 267 CO -0.03 0.28 -0.25 -0.07 -1.07 0.00 0.00 179.97 178.82 1xi9 h LEU 268 N 0.43 0.77 -1.22 3.04 3.38 -1.04 -2.71 115.31 117.95 1xi9 h LEU 268 Ca 0.25 -0.45 0.08 0.00 0.09 0.00 0.00 57.88 57.86 1xi9 h LEU 268 Cb 0.24 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 40.72 1xi9 h LEU 268 CO -0.23 1.05 0.56 0.00 0.09 0.00 0.00 178.44 179.92 1xi9 h ALA 269 N 0.73 1.63 -0.33 1.53 0.00 -0.28 -3.09 119.26 119.45 1xi9 h ALA 269 Ca 0.06 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 1xi9 h ALA 269 Cb 0.81 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1xi9 h ALA 269 CO 0.07 0.22 -0.17 0.00 0.00 0.00 0.00 179.25 179.36 1xi9 h ARG 270 N 0.89 0.70 0.00 0.00 3.08 -0.82 -3.14 114.38 115.09 1xi9 h ARG 270 Ca 0.39 -0.31 -0.03 0.00 0.07 0.00 0.00 59.98 60.10 1xi9 h ARG 270 Cb 0.34 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.37 1xi9 h ARG 270 CO -0.16 0.91 -0.14 -0.84 -1.07 0.00 0.00 179.97 178.68 1xi9 h ILE 271 N 0.47 0.45 -0.38 2.04 3.07 -1.42 -2.39 117.51 119.36 1xi9 h ILE 271 Ca 0.07 -0.74 0.00 0.00 1.55 0.00 0.00 64.86 65.75 1xi9 h ILE 271 Cb 0.71 1.52 0.00 0.00 -0.27 0.00 0.00 36.82 38.78 1xi9 h ILE 271 CO 0.05 0.14 0.00 -2.11 -1.05 0.00 0.00 178.15 175.18 1xi9 n ARG 272 N -3.43 2.32 0.00 0.16 0.00 -1.20 -5.01 116.66 109.49 1xi9 n ARG 272 Ca -0.01 -2.00 0.00 0.00 -0.00 0.00 0.00 57.85 55.84 1xi9 n ARG 272 Cb 0.31 -1.48 0.00 0.00 -0.00 0.00 0.00 32.46 31.29 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 1.19 0.00 -3.59 2.89 4.77 -0.90 -4.83 117.00 116.53 1xi9 n LEU 273 Ca 0.19 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 56.13 1xi9 n LEU 273 Cb 0.53 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.60 1xi9 n LEU 273 CO 0.15 0.00 0.98 0.00 -1.33 0.00 0.00 177.39 177.19 1xi9 n PRO 275 N -0.16 -0.63 -1.78 0.00 -0.04 -1.26 -5.00 135.00 126.13 1xi9 n PRO 275 Ca -0.02 -1.17 -0.41 0.00 -0.04 0.00 0.00 63.50 61.87 1xi9 n PRO 275 Cb 0.59 -0.72 -0.01 0.00 -0.04 0.00 0.00 33.50 33.33 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 -3.64 6.34 -0.05 3.54 3.84 -1.26 -4.76 114.94 118.95 1xi9 s ASN 276 Ca 0.41 3.03 -0.00 0.00 0.21 0.00 0.00 52.86 56.51 1xi9 s ASN 276 Cb -0.01 -2.66 -0.00 0.00 -0.55 0.00 0.00 41.25 38.03 1xi9 s ASN 276 CO 0.29 -0.90 0.03 0.74 -2.79 0.00 0.00 177.10 174.47 1xi9 h THR 277 N 3.10 0.00 -0.93 -5.21 2.02 -1.87 -3.36 112.91 106.66 1xi9 h THR 277 Ca -0.50 -0.50 0.16 0.00 0.77 0.00 0.00 66.41 66.34 1xi9 h THR 277 Cb 1.23 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.56 1xi9 h THR 277 CO 0.69 0.00 0.60 1.55 0.37 0.00 0.00 175.52 178.73 1xi9 h PRO 278 N -0.52 0.70 -0.11 6.66 0.13 -1.91 -1.05 132.00 135.89 1xi9 h PRO 278 Ca -0.00 -0.04 0.03 0.00 -0.87 0.00 0.00 66.00 65.12 1xi9 h PRO 278 Cb 0.01 -0.16 -0.00 0.00 0.13 0.00 0.00 31.00 30.98 1xi9 h PRO 278 CO 0.00 0.46 0.13 0.00 -0.23 0.00 0.00 178.00 178.36 1xi9 h ALA 279 N 1.60 1.68 -0.06 -0.56 0.00 -1.90 -1.78 119.26 118.25 1xi9 h ALA 279 Ca 0.49 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 55.29 1xi9 h ALA 279 Cb 0.78 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1xi9 h ALA 279 CO -0.25 -0.19 -0.44 1.96 0.00 0.00 0.00 179.25 180.34 1xi9 h GLN 280 N 0.00 0.12 -0.49 0.00 4.20 -1.33 -0.90 115.11 116.71 1xi9 h GLN 280 Ca 0.05 -0.06 -0.11 0.00 0.06 0.00 0.00 58.65 58.59 1xi9 h GLN 280 Cb 0.32 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 1xi9 h GLN 280 CO -0.00 0.54 -0.15 0.74 -0.67 0.00 0.00 178.83 179.30 1xi9 h PHE 281 N 0.10 1.07 -0.83 2.96 -1.00 -1.44 -0.90 116.94 116.90 1xi9 h PHE 281 Ca 0.01 -0.23 -0.03 0.00 2.81 0.00 0.00 57.97 60.53 1xi9 h PHE 281 Cb 0.82 -0.26 -0.04 0.00 3.61 0.00 0.00 35.95 40.08 1xi9 h PHE 281 CO 0.01 1.02 0.42 0.00 -1.61 0.00 0.00 178.31 178.14 1xi9 h ALA 282 N 0.99 1.18 -0.51 2.45 0.00 -1.45 -1.95 119.26 119.96 1xi9 h ALA 282 Ca 0.13 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1xi9 h ALA 282 Cb 0.70 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1xi9 h ALA 282 CO 0.05 0.64 0.25 0.00 0.00 0.00 0.00 179.25 180.19 1xi9 h ALA 283 N 1.29 0.66 -0.65 0.00 0.00 -0.98 -0.99 119.26 118.58 1xi9 h ALA 283 Ca 0.29 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.11 1xi9 h ALA 283 Cb 0.08 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1xi9 h ALA 283 CO -0.04 0.22 0.40 0.82 0.00 0.00 0.00 179.25 180.65 1xi9 h ILE 284 N 0.68 1.06 -0.33 0.00 2.04 -0.95 -0.06 117.51 119.96 1xi9 h ILE 284 Ca 0.18 -0.27 -0.06 0.00 1.00 0.00 0.00 64.86 65.71 1xi9 h ILE 284 Cb 0.11 0.22 -0.02 0.00 -0.74 0.00 0.00 36.82 36.40 1xi9 h ILE 284 CO -0.02 0.14 -0.05 0.00 0.00 0.00 0.00 178.15 178.22 1xi9 h ALA 285 N 1.29 1.32 0.07 1.87 0.00 -0.88 -2.10 119.26 120.84 1xi9 h ALA 285 Ca 0.27 -0.23 -0.28 0.00 0.00 0.00 0.00 54.91 54.67 1xi9 h ALA 285 Cb 0.05 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 17.72 1xi9 h ALA 285 CO -0.12 0.46 -1.15 0.78 0.00 0.00 0.00 179.25 179.22 1xi9 h GLY 286 N 0.87 0.66 0.90 0.00 0.00 -0.82 -2.67 103.07 102.01 1xi9 h GLY 286 Ca 0.10 -1.30 -0.15 0.00 0.00 0.00 0.00 47.33 45.98 1xi9 h GLY 286 CO 0.02 1.14 -0.54 1.41 0.00 0.00 0.00 176.54 178.57 1xi9 h LEU 287 N 0.28 0.64 0.00 3.11 3.38 -0.95 -3.29 115.31 118.48 1xi9 h LEU 287 Ca -0.15 -0.65 0.00 0.00 0.09 0.00 0.00 57.88 57.16 1xi9 h LEU 287 Cb 1.82 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 42.38 1xi9 h LEU 287 CO 0.22 1.19 -0.29 0.71 0.09 0.00 0.00 178.44 180.36 1xi9 h THR 288 N 0.14 0.00 -4.38 0.22 1.35 -1.54 -3.45 112.91 105.24 1xi9 h THR 288 Ca -0.04 -0.70 -0.48 0.00 -0.55 0.00 0.00 66.41 64.64 1xi9 h THR 288 Cb 1.19 1.53 0.08 0.00 -1.73 0.00 0.00 68.15 69.22 1xi9 h THR 288 CO 0.11 0.00 0.38 -0.83 -0.25 0.00 0.00 175.52 174.93 1xi9 s GLY 289 N -3.88 1.62 0.57 5.82 0.00 -1.00 -5.05 107.32 105.39 1xi9 s GLY 289 Ca 0.07 -0.50 -0.19 0.00 0.00 0.00 0.00 44.72 44.10 1xi9 s GLY 289 CO 0.67 -0.11 1.17 2.56 0.00 0.00 0.00 173.10 177.39 1xi9 s PRO 290 N -5.37 3.16 -0.28 2.90 0.04 -1.26 -4.95 135.00 129.24 1xi9 s PRO 290 Ca 0.59 1.71 0.08 0.00 0.04 0.00 0.00 61.00 63.42 1xi9 s PRO 290 Cb -0.11 -1.97 0.65 0.00 0.04 0.00 0.00 34.50 33.11 1xi9 s PRO 290 CO 0.50 -1.03 1.66 -1.33 0.04 0.00 0.00 177.00 176.84 1xi9 n MET 291 N -1.46 3.42 -0.13 4.56 2.81 -1.26 -4.57 117.12 120.48 1xi9 n MET 291 Ca 0.13 -2.65 -0.06 0.00 -1.81 0.00 0.00 57.70 53.30 1xi9 n MET 291 Cb 0.50 -2.10 0.02 0.00 -0.71 0.00 0.00 33.22 30.93 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 2.37 0.32 -1.02 7.83 3.45 -2.02 -2.59 116.42 124.77 1xi9 h ASP 292 Ca 0.23 0.02 0.32 0.00 0.43 0.00 0.00 57.03 58.03 1xi9 h ASP 292 Cb 2.12 -0.05 -0.15 0.00 -0.56 0.00 0.00 39.33 40.70 1xi9 h ASP 292 CO 0.64 0.23 0.58 0.10 -1.57 0.00 0.00 179.24 179.23 1xi9 h TYR 293 N 0.43 0.91 0.00 4.55 -0.00 -2.02 -0.83 116.97 120.01 1xi9 h TYR 293 Ca 0.17 0.04 -0.13 0.00 -0.00 0.00 0.00 58.73 58.81 1xi9 h TYR 293 Cb 0.07 -0.24 -0.02 0.00 -0.00 0.00 0.00 36.73 36.54 1xi9 h TYR 293 CO -0.09 -0.17 -0.61 1.25 -0.00 0.00 0.00 178.16 178.54 1xi9 h LEU 294 N 0.32 0.00 -0.43 0.10 5.85 -1.82 -3.20 115.31 116.13 1xi9 h LEU 294 Ca 0.73 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 59.45 1xi9 h LEU 294 Cb 1.70 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.71 1xi9 h LEU 294 CO -0.59 0.61 0.25 0.50 -0.34 0.00 0.00 178.44 178.87 1xi9 h LYS 295 N 0.00 0.59 -0.50 1.25 3.64 -1.19 0.14 116.57 120.49 1xi9 h LYS 295 Ca -0.01 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.26 1xi9 h LYS 295 Cb 1.18 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.86 1xi9 h LYS 295 CO 0.08 0.45 0.09 1.49 -2.27 0.00 0.00 179.45 179.29 1xi9 h GLU 296 N 0.56 0.77 -0.03 1.90 4.81 -1.60 -2.56 114.58 118.43 1xi9 h GLU 296 Ca 0.15 -0.16 -0.19 0.00 -0.13 0.00 0.00 59.36 59.03 1xi9 h GLU 296 Cb 0.02 -0.11 0.01 0.00 0.63 0.00 0.00 28.75 29.30 1xi9 h GLU 296 CO -0.03 0.72 -0.71 1.88 -0.73 0.00 0.00 179.01 180.15 1xi9 h TYR 297 N 0.74 0.76 -0.21 0.92 0.99 -1.48 -3.21 116.97 115.49 1xi9 h TYR 297 Ca 0.16 -0.40 -0.01 0.00 2.00 0.00 0.00 58.73 60.49 1xi9 h TYR 297 Cb 0.32 -0.09 -0.01 0.00 1.00 0.00 0.00 36.73 37.94 1xi9 h TYR 297 CO 0.02 1.21 0.09 0.52 -0.00 0.00 0.00 178.16 180.00 1xi9 h MET 298 N 0.09 0.28 0.45 4.88 2.86 -0.68 -1.72 114.93 121.10 1xi9 h MET 298 Ca -0.08 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.51 1xi9 h MET 298 Cb 1.39 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.99 1xi9 h MET 298 CO 0.14 0.23 -0.22 0.87 1.06 0.00 0.00 176.91 179.00 1xi9 h LYS 299 N 0.29 -0.58 -0.74 1.72 6.56 -1.47 -0.04 116.57 122.30 1xi9 h LYS 299 Ca 0.07 0.04 0.04 0.00 -1.06 0.00 0.00 60.65 59.74 1xi9 h LYS 299 Cb 0.05 0.13 -0.05 0.00 -0.57 0.00 0.00 32.23 31.79 1xi9 h LYS 299 CO -0.01 -0.39 0.46 0.87 -2.06 0.00 0.00 179.45 178.33 1xi9 h LYS 300 N -0.61 0.86 -0.51 3.15 1.57 -1.51 -2.22 116.57 117.30 1xi9 h LYS 300 Ca -0.06 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.61 1xi9 h LYS 300 Cb 0.47 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 1xi9 h LYS 300 CO 0.10 0.57 0.10 -0.07 -0.57 0.00 0.00 179.45 179.58 1xi9 h LEU 301 N 0.89 0.81 -0.56 2.94 3.38 -1.22 -1.83 115.31 119.71 1xi9 h LEU 301 Ca 0.30 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1xi9 h LEU 301 Cb 0.05 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1xi9 h LEU 301 CO -0.13 0.85 0.32 0.50 0.09 0.00 0.00 178.44 180.08 1xi9 h LYS 302 N 0.73 0.77 -0.19 1.13 3.64 -0.86 0.21 116.57 122.00 1xi9 h LYS 302 Ca 0.16 -0.08 -0.08 0.00 -1.27 0.00 0.00 60.65 59.37 1xi9 h LYS 302 Cb 0.38 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 1xi9 h LYS 302 CO 0.01 0.57 -0.25 1.05 -2.27 0.00 0.00 179.45 178.56 1xi9 h GLU 303 N 0.75 0.35 -0.36 1.90 4.11 -1.32 -0.08 114.58 119.93 1xi9 h GLU 303 Ca 0.20 -0.12 -0.15 0.00 0.07 0.00 0.00 59.36 59.36 1xi9 h GLU 303 Cb 0.02 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1xi9 h GLU 303 CO -0.03 0.58 -0.38 0.00 0.07 0.00 0.00 179.01 179.25 1xi9 h ARG 304 N 0.31 0.85 0.49 1.06 3.08 -1.08 -1.30 114.38 117.79 1xi9 h ARG 304 Ca 0.05 -0.43 -0.02 0.00 0.07 0.00 0.00 59.98 59.64 1xi9 h ARG 304 Cb 0.62 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.68 1xi9 h ARG 304 CO 0.04 1.07 -0.24 -0.09 -1.07 0.00 0.00 179.97 179.69 1xi9 h ARG 305 N 0.70 -0.65 -0.57 0.04 1.12 -0.32 -1.83 114.38 112.87 1xi9 h ARG 305 Ca 0.06 0.04 0.09 0.00 -1.11 0.00 0.00 59.98 59.06 1xi9 h ARG 305 Cb 0.95 0.15 -0.07 0.00 -0.01 0.00 0.00 29.97 30.98 1xi9 h ARG 305 CO 0.09 -0.43 0.20 -0.44 -3.11 0.00 0.00 179.97 176.28 1xi9 h ASP 306 N -0.67 0.18 -0.03 -3.80 3.32 -0.99 -2.12 116.42 112.32 1xi9 h ASP 306 Ca -0.07 0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 1xi9 h ASP 306 Cb 0.52 0.06 -0.00 0.00 0.22 0.00 0.00 39.33 40.13 1xi9 h ASP 306 CO 0.10 0.12 0.01 0.22 -1.72 0.00 0.00 179.24 177.97 1xi9 h TYR 307 N 0.37 0.04 -0.40 4.55 5.03 -1.17 -2.08 116.97 123.31 1xi9 h TYR 307 Ca 0.28 -0.00 -0.11 0.00 2.58 0.00 0.00 58.73 61.48 1xi9 h TYR 307 Cb 0.34 -0.01 -0.02 0.00 1.55 0.00 0.00 36.73 38.60 1xi9 h TYR 307 CO -0.17 0.18 -0.19 0.97 -1.32 0.00 0.00 178.16 177.63 1xi9 h ILE 308 N -0.12 1.27 -0.23 1.81 2.10 -1.21 -0.99 117.51 120.15 1xi9 h ILE 308 Ca 0.01 -1.28 -0.01 0.00 1.08 0.00 0.00 64.86 64.66 1xi9 h ILE 308 Cb 0.16 1.16 -0.01 0.00 -1.09 0.00 0.00 36.82 37.04 1xi9 h ILE 308 CO -0.00 0.43 0.11 0.22 -1.08 0.00 0.00 178.15 177.83 1xi9 h TYR 309 N 0.68 0.33 0.77 2.19 5.03 -1.40 0.12 116.97 124.69 1xi9 h TYR 309 Ca 0.10 -0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.36 1xi9 h TYR 309 Cb 0.69 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 38.86 1xi9 h TYR 309 CO 0.04 0.33 -0.49 -0.22 -1.32 0.00 0.00 178.16 176.49 1xi9 h LYS 310 N 0.24 -1.14 -0.67 1.82 3.64 -1.28 -2.36 116.57 116.82 1xi9 h LYS 310 Ca 0.08 0.08 0.14 0.00 -1.27 0.00 0.00 60.65 59.67 1xi9 h LYS 310 Cb 0.12 0.26 -0.10 0.00 -0.41 0.00 0.00 32.23 32.10 1xi9 h LYS 310 CO -0.01 -0.76 0.15 0.00 -2.27 0.00 0.00 179.45 176.56 1xi9 h ARG 311 N -1.18 0.26 -0.51 1.90 2.47 -1.11 -2.33 114.38 113.88 1xi9 h ARG 311 Ca -0.10 -0.02 -0.11 0.00 -1.26 0.00 0.00 59.98 58.49 1xi9 h ARG 311 Cb 0.96 -0.06 -0.02 0.00 -1.65 0.00 0.00 29.97 29.20 1xi9 h ARG 311 CO 0.09 0.17 -0.12 -0.07 0.56 0.00 0.00 179.97 180.60 1xi9 h LEU 312 N 0.27 1.00 -1.28 3.04 3.38 -0.71 -2.97 115.31 118.05 1xi9 h LEU 312 Ca 0.37 -0.36 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1xi9 h LEU 312 Cb 0.59 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1xi9 h LEU 312 CO -0.46 1.13 -0.20 0.78 0.09 0.00 0.00 178.44 179.77 1xi9 h ASN 313 N 0.86 0.00 -0.29 -0.43 2.35 -1.13 -2.89 115.58 114.04 1xi9 h ASN 313 Ca 0.13 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1xi9 h ASN 313 Cb 0.69 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.06 1xi9 h ASN 313 CO 0.05 0.20 0.00 -1.84 -1.65 0.00 0.00 177.43 174.19 1xi9 n GLU 314 N -3.43 2.29 -3.72 0.81 0.28 -0.90 -4.74 120.64 111.23 1xi9 n GLU 314 Ca -0.00 -1.30 -0.38 0.00 -0.16 0.00 0.00 57.16 55.32 1xi9 n GLU 314 Cb 0.39 -1.58 -0.12 0.00 1.43 0.00 0.00 31.44 31.56 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 -1.68 4.00 0.11 3.84 1.01 -1.09 -5.08 121.20 122.32 1xi9 s ILE 315 Ca 0.23 -0.95 -0.36 0.00 0.00 0.00 0.00 60.65 59.58 1xi9 s ILE 315 Cb 0.15 -3.20 -0.16 0.00 0.01 0.00 0.00 42.46 39.26 1xi9 s ILE 315 CO 0.11 -0.11 1.40 -2.65 0.00 0.00 0.00 174.94 173.68 1xi9 n PRO 316 N 4.87 1.43 -0.21 2.79 -0.02 -1.26 -1.67 135.00 140.92 1xi9 n PRO 316 Ca -0.13 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 1xi9 n PRO 316 Cb 0.46 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 1xi9 n PRO 316 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xi9 n GLY 317 N 2.74 0.72 3.04 -1.23 0.00 -1.26 -4.91 105.19 104.29 1xi9 n GLY 317 Ca 0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.51 1.12 0.08 -0.61 -1.09 -0.67 -0.43 121.20 117.08 1xi9 s ILE 318 Ca 0.00 -0.49 0.02 0.00 -2.23 0.00 0.00 60.65 57.95 1xi9 s ILE 318 Cb 0.00 -1.01 -0.03 0.00 -1.58 0.00 0.00 42.46 39.83 1xi9 s ILE 318 CO 0.00 0.35 -0.08 -0.94 -1.23 0.00 0.00 174.94 173.04 1xi9 s SER 319 N 0.50 1.11 0.04 3.58 1.04 -0.91 -4.57 113.70 114.48 1xi9 s SER 319 Ca -0.11 -0.82 -0.18 0.00 0.48 0.00 0.00 55.95 55.32 1xi9 s SER 319 Cb -0.14 0.06 0.04 0.00 0.10 0.00 0.00 66.02 66.07 1xi9 s SER 319 CO 0.03 -0.34 0.42 0.28 0.98 0.00 0.00 173.24 174.61 1xi9 s THR 320 N -2.65 0.05 0.73 2.02 -1.32 -1.26 0.62 115.64 113.82 1xi9 s THR 320 Ca 0.03 -0.44 -0.12 0.00 -1.21 0.00 0.00 61.69 59.96 1xi9 s THR 320 Cb -0.01 -0.93 0.03 0.00 -1.51 0.00 0.00 72.50 70.07 1xi9 s THR 320 CO -0.02 -0.24 1.11 0.42 -2.21 0.00 0.00 174.62 173.67 1xi9 s THR 321 N -2.35 3.30 -0.38 5.08 -4.23 -1.26 -4.97 115.64 110.83 1xi9 s THR 321 Ca -0.06 0.42 -0.19 0.00 -1.18 0.00 0.00 61.69 60.68 1xi9 s THR 321 Cb -0.01 -3.39 0.01 0.00 1.34 0.00 0.00 72.50 70.45 1xi9 s THR 321 CO -0.01 -0.55 0.56 -0.75 -0.54 0.00 0.00 174.62 173.33 1xi9 s LYS 322 N -5.36 3.48 0.32 3.99 2.20 -1.26 -4.83 119.74 118.28 1xi9 s LYS 322 Ca 0.59 -0.25 -0.29 0.00 -0.36 0.00 0.00 55.97 55.65 1xi9 s LYS 322 Cb -0.11 -3.87 -0.11 0.00 -1.51 0.00 0.00 37.83 32.23 1xi9 s LYS 322 CO 0.52 -0.79 1.57 -2.30 -0.36 0.00 0.00 175.35 173.99 1xi9 n PRO 323 N 5.93 2.72 0.00 4.03 -0.02 -1.26 -4.93 135.00 141.47 1xi9 n PRO 323 Ca -0.04 0.96 0.06 0.00 -2.02 0.00 0.00 63.50 62.47 1xi9 n PRO 323 Cb 0.48 -2.74 -0.07 0.00 -0.02 0.00 0.00 33.50 31.16 1xi9 n PRO 323 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1xi9 n GLN 324 N 1.61 2.90 -3.87 -0.52 6.02 0.12 -4.86 117.38 118.78 1xi9 n GLN 324 Ca 0.06 -0.00 -0.08 0.00 -0.01 0.00 0.00 57.00 56.97 1xi9 n GLN 324 Cb 0.38 -1.09 -0.03 0.00 1.02 0.00 0.00 30.24 30.52 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 -2.17 0.06 0.00 1.08 0.00 -0.66 -1.97 107.32 103.67 1xi9 s GLY 325 Ca 0.05 -0.43 0.00 0.00 0.00 0.00 0.00 44.72 44.34 1xi9 s GLY 325 CO 0.51 -0.25 0.00 0.00 0.00 0.00 0.00 173.10 173.36 1xi9 n ALA 326 N -0.42 0.00 -2.27 3.20 0.00 -0.08 -4.44 120.51 116.50 1xi9 n ALA 326 Ca -0.04 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.42 1xi9 n ALA 326 Cb 0.60 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.13 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 -0.01 0.32 -4.39 0.00 1.16 -1.26 -4.94 117.46 108.34 1xi9 n PHE 327 Ca 0.00 -1.08 -0.29 0.00 -1.87 0.00 0.00 57.45 54.21 1xi9 n PHE 327 Cb 0.00 -0.20 -0.12 0.00 -1.61 0.00 0.00 39.48 37.55 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 -1.56 2.44 0.06 2.97 2.02 -1.26 -1.80 117.35 120.21 1xi9 s TYR 328 Ca 0.35 -0.32 0.06 0.00 -0.37 0.00 0.00 57.07 56.80 1xi9 s TYR 328 Cb 0.38 -1.32 -0.03 0.00 -0.40 0.00 0.00 41.96 40.59 1xi9 s TYR 328 CO -0.11 0.35 -0.18 -1.50 -1.57 0.00 0.00 175.55 172.53 1xi9 s ILE 329 N -1.08 1.42 -0.54 2.71 2.07 0.03 -4.23 121.20 121.57 1xi9 s ILE 329 Ca 0.16 -1.22 0.07 0.00 -1.41 0.00 0.00 60.65 58.25 1xi9 s ILE 329 Cb -0.10 -1.28 0.26 0.00 0.13 0.00 0.00 42.46 41.47 1xi9 s ILE 329 CO 0.08 0.03 0.68 0.33 -1.91 0.00 0.00 174.94 174.15 1xi9 n PHE 330 N 1.63 2.20 -1.68 3.50 7.35 -1.26 -1.29 117.46 127.92 1xi9 n PHE 330 Ca -0.18 -3.94 -0.33 0.00 -0.76 0.00 0.00 57.45 52.24 1xi9 n PHE 330 Cb 0.54 -0.48 0.06 0.00 0.35 0.00 0.00 39.48 39.95 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 -2.09 2.63 -0.11 -7.13 0.02 -1.04 -4.73 135.00 122.56 1xi9 s PRO 331 Ca 0.39 1.48 -0.09 0.00 0.02 0.00 0.00 61.00 62.79 1xi9 s PRO 331 Cb 0.17 -1.92 -0.04 0.00 0.02 0.00 0.00 34.50 32.72 1xi9 s PRO 331 CO -0.05 -1.39 0.20 0.21 -0.33 0.00 0.00 177.00 175.63 1xi9 s LYS 332 N -4.05 3.64 -0.57 5.54 2.20 0.20 -1.84 119.74 124.87 1xi9 s LYS 332 Ca 0.69 -0.02 -0.19 0.00 -0.36 0.00 0.00 55.97 56.08 1xi9 s LYS 332 Cb -0.22 -3.23 0.09 0.00 -1.51 0.00 0.00 37.83 32.96 1xi9 s LYS 332 CO 0.42 0.69 0.69 0.42 -0.36 0.00 0.00 175.35 177.21 1xi9 s ILE 333 N -0.83 4.82 -0.05 5.43 1.01 0.10 -2.14 121.20 129.54 1xi9 s ILE 333 Ca 0.16 -0.83 -0.06 0.00 0.00 0.00 0.00 60.65 59.92 1xi9 s ILE 333 Cb -0.13 -4.44 -0.03 0.00 0.01 0.00 0.00 42.46 37.87 1xi9 s ILE 333 CO 0.05 -1.05 0.30 -0.33 0.00 0.00 0.00 174.94 173.92 1xi9 h GLU 334 N 9.15 -0.21 -6.86 2.79 5.08 -1.04 -3.47 114.58 120.01 1xi9 h GLU 334 Ca -0.29 0.01 -0.69 0.00 -1.00 0.00 0.00 59.36 57.40 1xi9 h GLU 334 Cb 1.09 0.05 -0.22 0.00 0.50 0.00 0.00 28.75 30.17 1xi9 h GLU 334 CO 1.07 -0.14 -0.86 0.54 -1.00 0.00 0.00 179.01 178.61 1xi9 s VAL 335 N -2.24 2.36 0.00 3.13 0.11 -1.22 -5.07 120.40 117.46 1xi9 s VAL 335 Ca -0.03 -1.69 0.00 0.00 -2.93 0.00 0.00 61.98 57.33 1xi9 s VAL 335 Cb 0.00 -2.04 0.00 0.00 -1.53 0.00 0.00 36.38 32.81 1xi9 s VAL 335 CO 0.10 0.11 0.00 0.61 -3.33 0.00 0.00 175.10 172.59 1xi9 n GLY 336 N 0.95 1.96 0.16 6.54 0.00 -1.26 -4.86 105.19 108.68 1xi9 n GLY 336 Ca -0.18 -0.92 0.13 0.00 0.00 0.00 0.00 46.02 45.05 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 -7.01 1.61 0.14 -2.01 -3.48 132.00 121.26 1xi9 h PRO 337 Ca 0.00 0.00 -0.49 0.00 0.14 0.00 0.00 66.00 65.65 1xi9 h PRO 337 Cb 0.00 0.00 0.04 0.00 0.14 0.00 0.00 31.00 31.18 1xi9 h PRO 337 CO 0.00 0.00 0.43 -1.58 0.14 0.00 0.00 178.00 176.99 1xi9 s TRP 338 N -3.24 3.04 0.13 1.56 0.51 -1.26 -4.97 118.94 114.71 1xi9 s TRP 338 Ca 0.07 1.59 0.13 0.00 -2.12 0.00 0.00 56.10 55.77 1xi9 s TRP 338 Cb 0.10 -3.21 0.24 0.00 -0.81 0.00 0.00 33.47 29.79 1xi9 s TRP 338 CO 0.56 -1.02 1.53 1.57 -0.51 0.00 0.00 176.95 179.08 1xi9 h LYS 339 N 2.05 0.00 -3.12 4.98 2.10 -1.96 -3.48 116.57 117.14 1xi9 h LYS 339 Ca -0.49 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.12 1xi9 h LYS 339 Cb 1.23 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.55 1xi9 h LYS 339 CO 0.60 0.63 0.22 0.54 -2.00 0.00 0.00 179.45 179.45 1xi9 s ASN 340 N -6.63 0.10 0.34 7.07 2.20 -1.26 -5.07 114.94 111.70 1xi9 s ASN 340 Ca 0.01 -1.18 0.18 0.00 -0.94 0.00 0.00 52.86 50.93 1xi9 s ASN 340 Cb 0.11 0.83 0.48 0.00 -2.00 0.00 0.00 41.25 40.66 1xi9 s ASN 340 CO 0.75 -1.65 1.63 -2.24 -2.94 0.00 0.00 177.10 172.66 1xi9 h ASP 341 N 2.01 0.00 0.46 3.54 2.03 -1.92 -2.61 116.42 119.93 1xi9 h ASP 341 Ca -0.32 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 55.96 1xi9 h ASP 341 Cb 1.25 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.75 1xi9 h ASP 341 CO 0.40 0.41 -0.22 0.50 -1.03 0.00 0.00 179.24 179.31 1xi9 h LYS 342 N 0.00 -0.59 -0.72 4.15 1.63 -1.94 -1.65 116.57 117.44 1xi9 h LYS 342 Ca -0.00 0.04 0.10 0.00 -0.85 0.00 0.00 60.65 59.94 1xi9 h LYS 342 Cb 1.07 0.13 -0.08 0.00 -0.60 0.00 0.00 32.23 32.76 1xi9 h LYS 342 CO 0.05 -0.36 0.35 1.49 -3.45 0.00 0.00 179.45 177.53 1xi9 h GLU 343 N -0.69 0.55 -0.39 1.90 4.81 -1.97 -1.76 114.58 117.04 1xi9 h GLU 343 Ca -0.06 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.16 1xi9 h GLU 343 Cb 0.51 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.73 1xi9 h GLU 343 CO 0.10 0.37 0.20 0.35 -0.73 0.00 0.00 179.01 179.30 1xi9 h PHE 344 N 0.57 0.36 -0.31 0.92 3.04 -1.40 -1.37 116.94 118.75 1xi9 h PHE 344 Ca 0.37 0.02 -0.13 0.00 3.98 0.00 0.00 57.97 62.20 1xi9 h PHE 344 Cb 0.43 -0.11 -0.01 0.00 2.56 0.00 0.00 35.95 38.82 1xi9 h PHE 344 CO -0.12 0.19 -0.35 0.28 -2.02 0.00 0.00 178.31 176.29 1xi9 h VAL 345 N 0.40 1.29 -0.43 1.41 2.07 -0.62 -0.58 116.25 119.78 1xi9 h VAL 345 Ca 0.16 -1.51 -0.12 0.00 0.82 0.00 0.00 66.70 66.06 1xi9 h VAL 345 Cb 0.06 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 1xi9 h VAL 345 CO -0.11 0.49 -0.20 -0.07 0.02 0.00 0.00 177.57 177.70 1xi9 h LEU 346 N 0.58 0.92 -0.45 2.57 3.38 -1.31 -1.95 115.31 119.06 1xi9 h LEU 346 Ca 0.06 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.61 1xi9 h LEU 346 Cb 0.88 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1xi9 h LEU 346 CO 0.08 1.12 0.22 -0.78 0.09 0.00 0.00 178.44 179.16 1xi9 h ASP 347 N 0.72 0.59 -0.90 -0.43 3.58 -1.03 -0.48 116.42 118.48 1xi9 h ASP 347 Ca 0.10 -0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.42 1xi9 h ASP 347 Cb 0.76 -0.15 -0.04 0.00 1.72 0.00 0.00 39.33 41.62 1xi9 h ASP 347 CO 0.06 0.55 0.58 0.58 -2.88 0.00 0.00 179.24 178.13 1xi9 h VAL 348 N 0.59 1.24 0.11 2.25 2.07 -1.12 -2.08 116.25 119.31 1xi9 h VAL 348 Ca 0.15 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 1xi9 h VAL 348 Cb 0.12 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 29.83 1xi9 h VAL 348 CO -0.02 0.24 -0.05 0.25 0.02 0.00 0.00 177.57 178.00 1xi9 h LEU 349 N 1.22 -0.13 -0.26 2.57 5.85 -0.99 0.35 115.31 123.92 1xi9 h LEU 349 Ca 0.33 -0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.99 1xi9 h LEU 349 Cb -0.11 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 1xi9 h LEU 349 CO -0.07 0.00 0.10 -0.74 -0.34 0.00 0.00 178.44 177.40 1xi9 h HIS 350 N -0.25 0.19 0.00 1.25 2.76 -0.96 -2.29 115.15 115.85 1xi9 h HIS 350 Ca -0.02 0.01 -0.23 0.00 -2.20 0.00 0.00 60.37 57.94 1xi9 h HIS 350 Cb 0.20 -0.04 -0.03 0.00 1.55 0.00 0.00 27.41 29.08 1xi9 h HIS 350 CO -0.04 0.09 -1.35 0.09 -1.30 0.00 0.00 177.93 175.43 1xi9 n ASN 351 N -5.02 1.87 -0.01 3.26 3.02 -0.79 -4.44 115.26 113.15 1xi9 n ASN 351 Ca -0.01 0.44 0.13 0.00 -0.03 0.00 0.00 54.58 55.10 1xi9 n ASN 351 Cb 0.09 -0.93 0.35 0.00 -0.61 0.00 0.00 39.78 38.68 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 -3.60 3.21 -3.69 5.41 0.00 0.06 -4.96 120.51 116.94 1xi9 n ALA 352 Ca -0.32 -0.29 -0.28 0.00 0.00 0.00 0.00 53.44 52.56 1xi9 n ALA 352 Cb 0.65 -1.21 0.03 0.00 0.00 0.00 0.00 19.45 18.91 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 -1.47 -2.21 -5.15 0.00 8.25 -0.86 -4.73 115.22 109.06 1xi9 n HIS 353 Ca 0.06 0.79 -0.31 0.00 -0.26 0.00 0.00 57.72 58.00 1xi9 n HIS 353 Cb 0.34 -3.92 -0.17 0.00 1.12 0.00 0.00 29.99 27.36 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 -3.22 1.93 -0.36 1.59 1.01 -1.25 -0.91 120.40 119.20 1xi9 s VAL 354 Ca 0.57 -0.96 -0.10 0.00 0.00 0.00 0.00 61.98 61.49 1xi9 s VAL 354 Cb -0.29 -1.66 0.02 0.00 0.00 0.00 0.00 36.38 34.46 1xi9 s VAL 354 CO 0.71 0.53 0.18 -0.22 0.00 0.00 0.00 175.10 176.31 1xi9 s LEU 355 N 0.21 4.57 0.51 3.92 2.96 0.12 -3.50 118.68 127.46 1xi9 s LEU 355 Ca -0.13 -0.95 0.08 0.00 -0.22 0.00 0.00 54.13 52.91 1xi9 s LEU 355 Cb -0.16 -2.00 0.04 0.00 0.50 0.00 0.00 46.19 44.57 1xi9 s LEU 355 CO 0.07 -0.35 0.56 -0.36 -1.32 0.00 0.00 176.35 174.95 1xi9 s PHE 356 N 1.54 1.98 -0.12 5.38 2.99 -1.26 -0.16 117.98 128.33 1xi9 s PHE 356 Ca 0.02 -0.65 -0.02 0.00 0.00 0.00 0.00 56.93 56.28 1xi9 s PHE 356 Cb -0.19 -2.15 -0.03 0.00 0.00 0.00 0.00 43.02 40.66 1xi9 s PHE 356 CO 0.06 -0.63 -0.06 0.08 -0.00 0.00 0.00 175.22 174.67 1xi9 s VAL 357 N -2.60 3.72 0.27 -0.44 1.01 -0.79 -4.78 120.40 116.79 1xi9 s VAL 357 Ca 0.50 -0.44 -0.29 0.00 0.00 0.00 0.00 61.98 61.75 1xi9 s VAL 357 Cb -0.05 -2.58 -0.10 0.00 0.00 0.00 0.00 36.38 33.65 1xi9 s VAL 357 CO 0.31 0.53 1.33 -1.38 0.00 0.00 0.00 175.10 175.89 1xi9 s HIS 358 N -0.03 3.12 0.42 5.22 -3.43 -1.26 -0.47 115.29 118.85 1xi9 s HIS 358 Ca 0.00 1.28 0.10 0.00 -0.80 0.00 0.00 55.06 55.63 1xi9 s HIS 358 Cb -0.13 -3.68 0.89 0.00 -1.43 0.00 0.00 32.58 28.23 1xi9 s HIS 358 CO 0.03 -2.02 2.01 0.78 -2.00 0.00 0.00 174.74 173.54 1xi9 h GLY 359 N 4.35 0.33 2.00 -1.38 0.00 -0.49 -1.67 103.07 106.22 1xi9 h GLY 359 Ca -0.47 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 46.70 1xi9 h GLY 359 CO 0.72 0.15 0.00 1.48 0.00 0.00 0.00 176.54 178.89 1xi9 h SER 360 N 0.31 0.00 0.16 0.19 4.64 -1.75 -1.10 113.55 116.00 1xi9 h SER 360 Ca 0.07 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.39 1xi9 h SER 360 Cb 0.16 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1xi9 h SER 360 CO -0.00 0.00 -0.03 1.23 -0.87 0.00 0.00 176.83 177.16 1xi9 h GLY 361 N 1.75 0.00 -3.87 -0.77 0.00 -1.65 -2.47 103.07 96.07 1xi9 h GLY 361 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.75 1xi9 h GLY 361 CO 0.00 0.00 0.75 0.69 0.00 0.00 0.00 176.54 177.98 1xi9 n PHE 362 N -3.51 2.84 -2.65 5.60 3.01 -0.41 -4.78 117.46 117.57 1xi9 n PHE 362 Ca -0.02 -2.66 0.08 0.00 1.01 0.00 0.00 57.45 55.86 1xi9 n PHE 362 Cb 0.13 -1.29 -0.02 0.00 -0.01 0.00 0.00 39.48 38.29 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 -0.68 -1.68 0.31 1.37 0.00 -0.93 -1.64 105.19 101.94 1xi9 n GLY 363 Ca 0.55 -1.20 0.06 0.00 0.00 0.00 0.00 46.02 45.44 1xi9 n GLY 363 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1xi9 h GLU 364 N 0.00 0.41 0.00 1.61 5.08 -1.89 -1.59 114.58 118.20 1xi9 h GLU 364 Ca 0.01 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1xi9 h GLU 364 Cb 0.54 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1xi9 h GLU 364 CO 0.00 0.27 0.00 0.66 -1.00 0.00 0.00 179.01 178.95 1xi9 n TYR 365 N -4.48 0.74 1.08 4.33 4.02 -1.26 -2.68 117.16 118.91 1xi9 n TYR 365 Ca 0.03 0.26 0.12 0.00 -0.01 0.00 0.00 57.90 58.31 1xi9 n TYR 365 Cb 0.12 -0.93 0.26 0.00 -0.02 0.00 0.00 39.34 38.77 1xi9 n TYR 365 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1xi9 n GLY 366 N 0.47 -0.98 3.68 2.72 0.00 -0.60 -4.54 105.19 105.95 1xi9 n GLY 366 Ca 0.04 -0.39 -0.40 0.00 0.00 0.00 0.00 46.02 45.26 1xi9 n GLY 366 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xi9 n ALA 367 N -1.17 1.02 -1.09 4.61 0.00 -1.09 -2.19 120.51 120.60 1xi9 n ALA 367 Ca 0.08 0.20 -0.03 0.00 0.00 0.00 0.00 53.44 53.69 1xi9 n ALA 367 Cb 0.34 -2.23 -0.01 0.00 0.00 0.00 0.00 19.45 17.55 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 0.92 0.62 3.26 0.00 0.00 -1.26 -4.90 105.19 103.82 1xi9 n GLY 368 Ca 0.08 -0.50 -0.14 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.02 1.32 0.03 1.61 4.02 -0.93 -0.72 115.29 118.60 1xi9 s HIS 369 Ca 0.00 -1.25 -0.00 0.00 1.02 0.00 0.00 55.06 54.83 1xi9 s HIS 369 Cb 0.00 -0.73 -0.03 0.00 -1.02 0.00 0.00 32.58 30.81 1xi9 s HIS 369 CO 0.00 -0.45 -0.03 -0.59 1.02 0.00 0.00 174.74 174.69 1xi9 s PHE 370 N -3.92 0.35 -0.11 1.40 -0.71 -0.76 0.11 117.98 114.34 1xi9 s PHE 370 Ca 0.36 -0.71 -0.04 0.00 -1.04 0.00 0.00 56.93 55.50 1xi9 s PHE 370 Cb 0.07 -0.26 -0.04 0.00 -1.21 0.00 0.00 43.02 41.59 1xi9 s PHE 370 CO 0.11 -0.25 0.04 0.50 -1.34 0.00 0.00 175.22 174.28 1xi9 s ARG 371 N -2.29 3.25 0.02 1.99 3.52 0.38 -2.49 118.95 123.33 1xi9 s ARG 371 Ca -0.08 -0.34 0.04 0.00 -0.13 0.00 0.00 55.73 55.22 1xi9 s ARG 371 Cb -0.04 -2.95 -0.02 0.00 -1.56 0.00 0.00 34.95 30.39 1xi9 s ARG 371 CO -0.04 0.64 -0.13 0.00 -0.81 0.00 0.00 175.30 174.96 1xi9 s ALA 372 N -0.69 1.05 0.08 6.12 0.00 -0.41 -1.88 121.76 126.04 1xi9 s ALA 372 Ca 0.11 -0.70 -0.12 0.00 0.00 0.00 0.00 51.96 51.25 1xi9 s ALA 372 Cb -0.12 -0.19 -0.06 0.00 0.00 0.00 0.00 23.12 22.75 1xi9 s ALA 372 CO 0.02 0.21 0.44 0.14 0.00 0.00 0.00 175.76 176.58 1xi9 s VAL 373 N -0.67 5.01 -0.29 0.00 -7.23 0.19 -0.79 120.40 116.62 1xi9 s VAL 373 Ca 0.02 0.64 0.10 0.00 -1.81 0.00 0.00 61.98 60.93 1xi9 s VAL 373 Cb -0.07 -3.69 0.58 0.00 0.56 0.00 0.00 36.38 33.76 1xi9 s VAL 373 CO 0.01 0.34 1.57 2.22 -0.31 0.00 0.00 175.10 178.93 1xi9 n PHE 374 N 1.07 1.55 -0.17 2.82 1.16 -0.75 -4.70 117.46 118.44 1xi9 n PHE 374 Ca -0.08 -1.37 0.03 0.00 -1.87 0.00 0.00 57.45 54.15 1xi9 n PHE 374 Cb 0.52 -0.54 0.31 0.00 -1.61 0.00 0.00 39.48 38.17 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 1.50 0.73-10.21 5.98 3.38 -1.94 -3.43 115.31 111.31 1xi9 h LEU 375 Ca 0.23 -0.01 -0.51 0.00 0.09 0.00 0.00 57.88 57.67 1xi9 h LEU 375 Cb 1.88 -0.17 0.12 0.00 0.09 0.00 0.00 40.66 42.58 1xi9 h LEU 375 CO 0.50 0.51 0.37 -2.84 0.09 0.00 0.00 178.44 177.06 1xi9 s PRO 376 N -5.73 2.58 0.71 1.13 0.02 -1.26 -4.71 135.00 127.74 1xi9 s PRO 376 Ca -0.10 1.44 -0.16 0.00 0.02 0.00 0.00 61.00 62.20 1xi9 s PRO 376 Cb 0.18 -1.92 -0.03 0.00 0.02 0.00 0.00 34.50 32.75 1xi9 s PRO 376 CO 0.77 -1.43 0.64 -2.30 -0.33 0.00 0.00 177.00 174.35 1xi9 n PRO 377 N -2.62 0.37 -0.32 5.54 -0.02 -1.26 -4.68 135.00 131.99 1xi9 n PRO 377 Ca 0.11 0.17 0.21 0.00 -2.02 0.00 0.00 63.50 61.96 1xi9 n PRO 377 Cb 0.52 -1.92 0.42 0.00 -0.02 0.00 0.00 33.50 32.50 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 -0.30 0.29 -0.70 4.25 1.08 -1.94 -1.13 117.51 119.06 1xi9 h ILE 378 Ca -0.46 -0.10 -0.01 0.00 -0.39 0.00 0.00 64.86 63.91 1xi9 h ILE 378 Cb 1.35 -0.01 -0.03 0.00 -3.07 0.00 0.00 36.82 35.05 1xi9 h ILE 378 CO 0.44 0.05 0.40 -0.33 -0.69 0.00 0.00 178.15 178.02 1xi9 h GLU 379 N 0.28 0.96 0.01 2.37 4.39 -1.99 0.28 114.58 120.87 1xi9 h GLU 379 Ca 0.69 -0.09 -0.18 0.00 0.34 0.00 0.00 59.36 60.11 1xi9 h GLU 379 Cb 1.53 -0.20 0.02 0.00 -0.10 0.00 0.00 28.75 29.99 1xi9 h GLU 379 CO -0.63 0.69 -0.72 0.82 -1.16 0.00 0.00 179.01 178.01 1xi9 h ILE 380 N 0.97 1.39 -0.52 3.13 2.04 -1.59 -2.73 117.51 120.20 1xi9 h ILE 380 Ca 0.25 -2.14 0.03 0.00 1.00 0.00 0.00 64.86 64.00 1xi9 h ILE 380 Cb -0.00 2.57 -0.04 0.00 -0.74 0.00 0.00 36.82 38.61 1xi9 h ILE 380 CO -0.04 0.63 0.30 -0.07 0.00 0.00 0.00 178.15 178.97 1xi9 h LEU 381 N 0.01 0.47 -0.37 1.44 3.38 -1.02 -0.38 115.31 118.84 1xi9 h LEU 381 Ca -0.09 0.01 0.06 0.00 0.09 0.00 0.00 57.88 57.95 1xi9 h LEU 381 Cb 1.42 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 42.03 1xi9 h LEU 381 CO 0.14 0.33 0.05 -0.08 0.09 0.00 0.00 178.44 178.98 1xi9 h GLU 382 N 0.59 0.17 -0.00 1.13 4.81 -0.53 0.52 114.58 121.27 1xi9 h GLU 382 Ca 0.21 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.45 1xi9 h GLU 382 Cb 0.05 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1xi9 h GLU 382 CO -0.11 0.11 -0.10 1.49 -0.73 0.00 0.00 179.01 179.67 1xi9 h GLU 383 N 0.17 -0.17 -0.58 1.92 4.81 -1.16 -1.47 114.58 118.10 1xi9 h GLU 383 Ca 0.18 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.42 1xi9 h GLU 383 Cb 0.22 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.61 1xi9 h GLU 383 CO -0.25 -0.11 0.36 0.00 -0.73 0.00 0.00 179.01 178.28 1xi9 h ALA 384 N 0.80 0.74 -0.02 2.92 0.00 -0.74 -2.77 119.26 120.18 1xi9 h ALA 384 Ca 0.04 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1xi9 h ALA 384 Cb 0.22 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1xi9 h ALA 384 CO -0.10 0.21 -0.63 0.52 0.00 0.00 0.00 179.25 179.24 1xi9 h MET 385 N 0.78 0.07 -0.02 0.00 2.86 -0.84 -1.93 114.93 115.84 1xi9 h MET 385 Ca 0.21 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.80 1xi9 h MET 385 Cb -0.04 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.63 1xi9 h MET 385 CO -0.04 0.68 0.01 -0.44 1.06 0.00 0.00 176.91 178.18 1xi9 h ASP 386 N 0.05 0.03 -0.57 1.22 3.32 -1.16 -0.79 116.42 118.51 1xi9 h ASP 386 Ca -0.01 -0.10 -0.06 0.00 0.02 0.00 0.00 57.03 56.88 1xi9 h ASP 386 Cb 1.13 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.65 1xi9 h ASP 386 CO 0.09 0.12 0.11 0.03 -1.72 0.00 0.00 179.24 177.88 1xi9 h ARG 387 N -0.07 0.94 -0.40 3.56 3.08 -1.46 -1.99 114.38 118.04 1xi9 h ARG 387 Ca 0.01 -0.24 -0.06 0.00 0.07 0.00 0.00 59.98 59.75 1xi9 h ARG 387 Cb 0.10 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 1xi9 h ARG 387 CO -0.00 0.88 0.00 0.35 -1.07 0.00 0.00 179.97 180.14 1xi9 h PHE 388 N 0.84 0.77 -0.72 3.04 3.57 -1.33 -0.86 116.94 122.25 1xi9 h PHE 388 Ca 0.18 -0.13 0.02 0.00 3.53 0.00 0.00 57.97 61.57 1xi9 h PHE 388 Cb 0.39 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 38.88 1xi9 h PHE 388 CO 0.03 0.78 0.46 1.49 -2.23 0.00 0.00 178.31 178.84 1xi9 h GLU 389 N 0.54 0.89 -0.33 1.11 4.81 -1.11 0.35 114.58 120.84 1xi9 h GLU 389 Ca 0.11 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1xi9 h GLU 389 Cb 0.47 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 1xi9 h GLU 389 CO 0.02 0.59 0.15 0.87 -0.73 0.00 0.00 179.01 179.90 1xi9 h LYS 390 N 0.91 0.47 -0.49 1.92 1.57 -1.15 -1.61 116.57 118.19 1xi9 h LYS 390 Ca 0.28 -0.07 0.07 0.00 -1.87 0.00 0.00 60.65 59.05 1xi9 h LYS 390 Cb -0.03 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.14 1xi9 h LYS 390 CO -0.09 0.45 0.16 0.35 -0.57 0.00 0.00 179.45 179.76 1xi9 h PHE 391 N 0.39 0.29 -0.54 -1.35 3.57 -0.85 -2.36 116.94 116.09 1xi9 h PHE 391 Ca 0.11 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.57 1xi9 h PHE 391 Cb 0.14 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 1xi9 h PHE 391 CO -0.01 0.09 0.09 0.52 -2.23 0.00 0.00 178.31 176.77 1xi9 h MET 392 N 0.34 0.89 -0.49 1.11 2.86 -0.68 -2.53 114.93 116.42 1xi9 h MET 392 Ca 0.23 -0.24 0.09 0.00 -2.06 0.00 0.00 59.70 57.72 1xi9 h MET 392 Cb 0.25 -0.10 -0.07 0.00 0.06 0.00 0.00 31.60 31.74 1xi9 h MET 392 CO -0.25 0.86 0.09 -0.22 1.06 0.00 0.00 176.91 178.45 1xi9 h LYS 393 N 0.77 0.21 -0.86 1.72 3.11 -1.09 -3.00 116.57 117.44 1xi9 h LYS 393 Ca 0.16 -0.01 -0.02 0.00 -2.81 0.00 0.00 60.65 57.97 1xi9 h LYS 393 Cb 0.40 -0.05 -0.04 0.00 -1.00 0.00 0.00 32.23 31.54 1xi9 h LYS 393 CO 0.01 0.14 0.46 1.49 -2.81 0.00 0.00 179.45 178.74 1xi9 h GLU 394 N 0.22 1.19 0.00 1.90 4.81 -1.01 -3.52 114.58 118.17 1xi9 h GLU 394 Ca 0.25 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1xi9 h GLU 394 Cb 0.34 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.48 1xi9 h GLU 394 CO -0.34 0.88 0.00 0.54 -0.73 0.00 0.00 179.01 179.36