#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xle n GLN 3 N 0.00 -0.75 -2.36 7.34 3.00 -1.26 -5.04 117.38 118.31 1xle n GLN 3 Ca 0.00 1.00 -0.41 0.00 -0.01 0.00 0.00 57.00 57.58 1xle n GLN 3 Cb 0.00 -2.25 -0.04 0.00 0.00 0.00 0.00 30.24 27.96 1xle n GLN 3 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1xle s PRO 4 N -0.79 4.52 0.12 -1.09 0.04 -1.26 -5.03 135.00 131.52 1xle s PRO 4 Ca 0.02 1.92 0.07 0.00 0.04 0.00 0.00 61.00 63.06 1xle s PRO 4 Cb -0.01 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.31 1xle s PRO 4 CO 0.19 0.01 -0.18 0.95 0.04 0.00 0.00 177.00 178.01 1xle s THR 5 N -0.71 1.55 0.51 1.26 -4.23 -1.26 -4.61 115.64 108.15 1xle s THR 5 Ca 0.49 -1.64 0.20 0.00 -1.18 0.00 0.00 61.69 59.56 1xle s THR 5 Cb -0.34 -1.54 0.29 0.00 1.34 0.00 0.00 72.50 72.25 1xle s THR 5 CO 0.42 -0.23 1.04 -2.65 -0.54 0.00 0.00 174.62 172.66 1xle n PRO 6 N 0.80 0.01 0.03 3.99 -0.02 -1.14 -1.14 135.00 137.54 1xle n PRO 6 Ca -0.17 0.84 0.12 0.00 -2.02 0.00 0.00 63.50 62.27 1xle n PRO 6 Cb 0.55 -2.10 0.51 0.00 -0.02 0.00 0.00 33.50 32.44 1xle n PRO 6 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xle n ALA 7 N -2.00 2.15 0.15 3.55 0.00 -1.26 -2.84 120.51 120.26 1xle n ALA 7 Ca 0.17 -0.06 -0.00 0.00 0.00 0.00 0.00 53.44 53.55 1xle n ALA 7 Cb 1.22 -1.42 0.23 0.00 0.00 0.00 0.00 19.45 19.48 1xle n ALA 7 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1xle h ASP 8 N 0.00 0.01 -3.13 0.00 3.32 -1.51 -3.48 116.42 111.64 1xle h ASP 8 Ca 0.00 -0.01 -0.21 0.00 0.02 0.00 0.00 57.03 56.83 1xle h ASP 8 Cb 0.50 -0.00 0.06 0.00 0.22 0.00 0.00 39.33 40.10 1xle h ASP 8 CO 0.00 0.54 -0.34 1.41 -1.72 0.00 0.00 179.24 179.13 1xle n HIS 9 N -3.91 -1.31 -2.65 4.55 8.25 -1.13 -4.63 115.22 114.39 1xle n HIS 9 Ca -0.01 0.42 -0.43 0.00 -0.26 0.00 0.00 57.72 57.44 1xle n HIS 9 Cb 0.54 -3.02 -0.02 0.00 1.12 0.00 0.00 29.99 28.61 1xle n HIS 9 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1xle s PHE 10 N -3.04 2.88 0.01 4.41 0.08 -1.25 -0.07 117.98 121.01 1xle s PHE 10 Ca 0.24 0.73 0.05 0.00 0.12 0.00 0.00 56.93 58.08 1xle s PHE 10 Cb -0.11 -4.24 -0.03 0.00 -0.57 0.00 0.00 43.02 38.07 1xle s PHE 10 CO 0.30 -1.16 -0.14 0.95 -0.10 0.00 0.00 175.22 175.07 1xle s THR 11 N 4.21 3.09 -0.01 0.64 -4.23 -0.99 0.12 115.64 118.47 1xle s THR 11 Ca 0.46 -0.97 0.03 0.00 -1.18 0.00 0.00 61.69 60.03 1xle s THR 11 Cb -0.08 -2.30 -0.01 0.00 1.34 0.00 0.00 72.50 71.45 1xle s THR 11 CO 0.28 0.41 -0.11 -0.36 -0.54 0.00 0.00 174.62 174.30 1xle s PHE 12 N -0.90 0.99 0.53 3.99 0.40 -1.15 -2.27 117.98 119.57 1xle s PHE 12 Ca 0.15 -0.20 -0.11 0.00 -0.60 0.00 0.00 56.93 56.16 1xle s PHE 12 Cb -0.11 -0.65 -0.05 0.00 0.51 0.00 0.00 43.02 42.72 1xle s PHE 12 CO 0.05 -0.04 0.93 0.20 0.70 0.00 0.00 175.22 177.06 1xle s GLY 13 N -0.16 1.78 0.34 4.36 0.00 -1.24 -2.24 107.32 110.15 1xle s GLY 13 Ca 0.03 -0.12 0.09 0.00 0.00 0.00 0.00 44.72 44.72 1xle s GLY 13 CO -0.00 0.12 1.79 -2.00 0.00 0.00 0.00 173.10 173.01 1xle h LEU 14 N 0.37 0.19 0.00 0.66 5.85 -1.69 -2.33 115.31 118.36 1xle h LEU 14 Ca -0.46 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.20 1xle h LEU 14 Cb 1.19 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.17 1xle h LEU 14 CO 0.62 0.51 0.00 -2.67 -0.34 0.00 0.00 178.44 176.57 1xle n TRP 15 N -4.11 0.00 0.01 1.25 2.14 -1.26 -1.15 117.44 114.31 1xle n TRP 15 Ca -0.01 0.00 -0.00 0.00 2.07 0.00 0.00 57.50 59.55 1xle n TRP 15 Cb 0.40 -0.44 -0.00 0.00 -0.81 0.00 0.00 31.31 30.46 1xle n TRP 15 CO 0.00 0.00 0.00 1.79 2.07 0.00 0.00 177.69 181.55 1xle h THR 16 N 0.00 0.00 -0.10 -1.67 1.35 -1.61 -3.08 112.91 107.80 1xle h THR 16 Ca 0.00 -0.09 -0.09 0.00 -0.55 0.00 0.00 66.41 65.68 1xle h THR 16 Cb 0.37 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 66.78 1xle h THR 16 CO 0.00 0.00 -0.34 -0.37 -0.25 0.00 0.00 175.52 174.56 1xle h VAL 17 N -0.12 1.28 0.00 6.82 -1.51 -1.68 -1.96 116.25 119.07 1xle h VAL 17 Ca -0.00 -1.32 0.00 0.00 -1.23 0.00 0.00 66.70 64.14 1xle h VAL 17 Cb 0.02 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 30.76 1xle h VAL 17 CO 0.00 0.39 0.00 0.61 -1.23 0.00 0.00 177.57 177.35 1xle n GLY 18 N -0.38 -0.86 3.61 5.19 0.00 -0.30 -4.82 105.19 107.62 1xle n GLY 18 Ca -0.01 -0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 1xle n GLY 18 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1xle s TRP 19 N -2.00 2.44 -1.07 1.61 -0.00 -0.74 -4.57 118.94 114.62 1xle s TRP 19 Ca 0.37 0.72 0.29 0.00 -0.00 0.00 0.00 56.10 57.48 1xle s TRP 19 Cb 0.17 -4.14 1.24 0.00 -0.00 0.00 0.00 33.47 30.74 1xle s TRP 19 CO 0.29 -2.02 1.92 2.41 -0.00 0.00 0.00 176.95 179.54 1xle n THR 20 N 6.74 0.00 0.00 5.86 -1.04 -1.26 -4.79 114.28 119.79 1xle n THR 20 Ca 0.16 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.17 1xle n THR 20 Cb 0.47 -0.45 0.00 0.00 -1.82 0.00 0.00 70.33 68.53 1xle n THR 20 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xle n GLY 21 N 1.47 1.07 3.71 3.41 0.00 -1.26 -0.36 105.19 113.22 1xle n GLY 21 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1xle n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xle s ALA 22 N -2.00 3.20 0.00 4.61 0.00 -1.26 -4.31 121.76 122.00 1xle s ALA 22 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 51.96 52.41 1xle s ALA 22 Cb 0.00 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.87 1xle s ALA 22 CO 0.00 -0.19 0.00 -0.40 0.00 0.00 0.00 175.76 175.17 1xle n ASP 23 N 3.83 1.98 0.06 0.00 5.75 -0.80 -4.95 116.55 122.42 1xle n ASP 23 Ca 0.04 -0.84 -0.03 0.00 -0.01 0.00 0.00 54.79 53.95 1xle n ASP 23 Cb 0.51 0.00 0.20 0.00 -1.03 0.00 0.00 41.12 40.80 1xle n ASP 23 CO 0.00 0.00 0.00 1.55 -0.11 0.00 0.00 177.20 178.64 1xle h PRO 24 N 0.00 0.34 -0.72 0.11 0.13 -2.01 -3.22 132.00 126.63 1xle h PRO 24 Ca 0.00 -0.16 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 1xle h PRO 24 Cb 0.00 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.12 1xle h PRO 24 CO 0.00 0.67 0.00 1.19 -0.23 0.00 0.00 178.00 179.63 1xle n PHE 25 N -4.05 1.19 -3.61 1.56 3.72 -1.26 -5.04 117.46 109.98 1xle n PHE 25 Ca -0.01 -0.54 -0.03 0.00 -0.05 0.00 0.00 57.45 56.81 1xle n PHE 25 Cb 0.47 -0.09 -0.01 0.00 -0.94 0.00 0.00 39.48 38.90 1xle n PHE 25 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1xle s GLY 26 N -0.96 -0.35 0.77 1.37 0.00 -1.22 -5.17 107.32 101.76 1xle s GLY 26 Ca 0.51 1.03 -0.09 0.00 0.00 0.00 0.00 44.72 46.17 1xle s GLY 26 CO 0.31 0.31 1.10 -1.34 0.00 0.00 0.00 173.10 173.47 1xle s VAL 27 N -2.68 2.16 0.42 1.40 -7.23 -1.26 -1.90 120.40 111.31 1xle s VAL 27 Ca 0.10 -0.20 -0.26 0.00 -1.81 0.00 0.00 61.98 59.81 1xle s VAL 27 Cb 0.01 -2.96 -0.08 0.00 0.56 0.00 0.00 36.38 33.90 1xle s VAL 27 CO -0.04 0.00 1.33 0.00 -0.31 0.00 0.00 175.10 176.08 1xle s ALA 28 N -3.41 3.23 -1.32 1.32 0.00 -1.26 -4.33 121.76 115.99 1xle s ALA 28 Ca 0.63 1.29 0.12 0.00 0.00 0.00 0.00 51.96 54.00 1xle s ALA 28 Cb -0.09 -3.51 0.20 0.00 0.00 0.00 0.00 23.12 19.72 1xle s ALA 28 CO 0.47 -0.93 1.06 0.25 0.00 0.00 0.00 175.76 176.60 1xle n THR 29 N -0.01 0.43 -4.15 0.00 -2.24 0.51 -4.92 114.28 103.89 1xle n THR 29 Ca 0.04 -0.72 -0.16 0.00 -2.27 0.00 0.00 64.05 60.95 1xle n THR 29 Cb 0.43 0.93 -0.11 0.00 -2.10 0.00 0.00 70.33 69.48 1xle n THR 29 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1xle s ARG 30 N -1.02 0.77 0.48 -0.78 0.52 -0.71 -4.99 118.95 113.23 1xle s ARG 30 Ca 0.19 -0.98 -0.20 0.00 -0.52 0.00 0.00 55.73 54.22 1xle s ARG 30 Cb 0.12 -0.64 -0.09 0.00 0.52 0.00 0.00 34.95 34.86 1xle s ARG 30 CO 0.16 0.13 1.03 -1.59 0.02 0.00 0.00 175.30 175.05 1xle s LYS 31 N -2.02 3.85 0.88 3.54 0.00 -1.26 -4.80 119.74 119.93 1xle s LYS 31 Ca -0.01 1.33 -0.13 0.00 0.00 0.00 0.00 55.97 57.16 1xle s LYS 31 Cb -0.08 -2.10 0.04 0.00 0.00 0.00 0.00 37.83 35.69 1xle s LYS 31 CO 0.01 -0.38 0.62 0.09 0.00 0.00 0.00 175.35 175.69 1xle n ASN 32 N -0.92 -1.20 -4.27 0.03 4.13 -1.26 -4.92 115.26 106.84 1xle n ASN 32 Ca 0.09 0.43 -0.35 0.00 1.68 0.00 0.00 54.58 56.43 1xle n ASN 32 Cb 0.53 -1.28 -0.14 0.00 -1.54 0.00 0.00 39.78 37.34 1xle n ASN 32 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1xle s LEU 33 N -2.16 3.00 0.17 3.41 2.96 -1.26 -5.08 118.68 119.72 1xle s LEU 33 Ca 0.62 -0.57 -0.32 0.00 -0.22 0.00 0.00 54.13 53.65 1xle s LEU 33 Cb -0.25 -1.71 -0.11 0.00 0.50 0.00 0.00 46.19 44.62 1xle s LEU 33 CO 0.62 -0.06 1.69 -0.62 -1.32 0.00 0.00 176.35 176.66 1xle s ASP 34 N 1.43 6.47 0.30 3.68 -1.08 -1.26 -4.88 116.67 121.32 1xle s ASP 34 Ca 0.04 2.74 -0.00 0.00 -0.52 0.00 0.00 52.55 54.81 1xle s ASP 34 Cb -0.15 -2.59 0.49 0.00 -1.46 0.00 0.00 42.92 39.21 1xle s ASP 34 CO -0.04 -0.92 1.92 -0.65 0.52 0.00 0.00 175.17 176.00 1xle h PRO 35 N 7.21 1.05 -0.70 4.34 0.11 -1.98 0.48 132.00 142.52 1xle h PRO 35 Ca -0.43 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 1xle h PRO 35 Cb 1.20 -0.24 -0.03 0.00 0.11 0.00 0.00 31.00 32.05 1xle h PRO 35 CO 0.94 0.69 0.18 0.28 -0.21 0.00 0.00 178.00 179.88 1xle h VAL 36 N 1.08 1.26 -0.56 3.15 2.07 -1.91 0.04 116.25 121.38 1xle h VAL 36 Ca 0.37 -0.96 -0.03 0.00 0.82 0.00 0.00 66.70 66.90 1xle h VAL 36 Cb 0.10 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1xle h VAL 36 CO -0.12 0.37 0.23 -0.08 0.02 0.00 0.00 177.57 177.98 1xle h GLU 37 N 1.05 0.83 -0.00 1.57 4.81 -1.66 -2.32 114.58 118.86 1xle h GLU 37 Ca 0.22 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1xle h GLU 37 Cb 0.36 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.61 1xle h GLU 37 CO 0.00 0.72 0.00 0.00 -0.73 0.00 0.00 179.01 179.00 1xle h ALA 38 N 1.07 0.01 0.09 2.92 0.00 -0.58 0.49 119.26 123.26 1xle h ALA 38 Ca 0.19 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1xle h ALA 38 Cb 0.19 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1xle h ALA 38 CO -0.02 -0.49 -0.07 0.28 0.00 0.00 0.00 179.25 178.96 1xle h VAL 39 N -0.01 0.85 0.26 0.00 2.07 -0.79 0.13 116.25 118.76 1xle h VAL 39 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1xle h VAL 39 Cb 0.01 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1xle h VAL 39 CO -0.00 0.00 -0.13 0.45 0.02 0.00 0.00 177.57 177.91 1xle h HIS 40 N -0.16 -0.33 -0.35 1.57 -0.00 -1.30 -1.66 115.15 112.92 1xle h HIS 40 Ca -0.00 -0.01 0.04 0.00 -0.00 0.00 0.00 60.37 60.40 1xle h HIS 40 Cb 0.15 0.11 -0.04 0.00 -0.00 0.00 0.00 27.41 27.63 1xle h HIS 40 CO -0.09 -0.16 0.13 -0.22 -0.00 0.00 0.00 177.93 177.59 1xle h LYS 41 N -0.41 0.28 0.30 2.45 1.63 -0.78 -1.95 116.57 118.08 1xle h LYS 41 Ca -0.04 -0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.75 1xle h LYS 41 Cb 0.32 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.86 1xle h LYS 41 CO 0.06 0.18 -0.28 -0.07 -3.45 0.00 0.00 179.45 175.89 1xle h LEU 42 N 0.28 -0.76 -0.71 5.20 3.38 -0.78 -2.11 115.31 119.81 1xle h LEU 42 Ca 0.16 0.07 0.13 0.00 0.09 0.00 0.00 57.88 58.33 1xle h LEU 42 Cb 0.13 0.26 -0.09 0.00 0.09 0.00 0.00 40.66 41.04 1xle h LEU 42 CO -0.16 -0.41 0.25 0.00 0.09 0.00 0.00 178.44 178.21 1xle h ALA 43 N -0.02 0.96 -0.62 1.53 0.00 -1.13 -1.17 119.26 118.82 1xle h ALA 43 Ca -0.01 0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.07 1xle h ALA 43 Cb 0.55 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.40 1xle h ALA 43 CO -0.05 -0.23 0.33 0.93 0.00 0.00 0.00 179.25 180.23 1xle h GLU 44 N 0.40 0.60 0.00 0.00 5.08 -1.02 -2.38 114.58 117.26 1xle h GLU 44 Ca 0.39 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 1xle h GLU 44 Cb 0.58 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1xle h GLU 44 CO -0.40 0.40 0.00 -0.07 -1.00 0.00 0.00 179.01 177.94 1xle h LEU 45 N 0.62 0.00 0.00 1.33 3.38 -0.54 -3.47 115.31 116.63 1xle h LEU 45 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1xle h LEU 45 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1xle h LEU 45 CO -0.18 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.96 1xle n GLY 46 N -0.36 0.94 3.74 0.83 0.00 -0.90 -4.75 105.19 104.70 1xle n GLY 46 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1xle n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xle s ALA 47 N -2.00 2.21 -0.13 4.61 0.00 -1.18 -2.87 121.76 122.40 1xle s ALA 47 Ca 0.00 0.65 0.14 0.00 0.00 0.00 0.00 51.96 52.74 1xle s ALA 47 Cb 0.00 -3.38 -0.24 0.00 0.00 0.00 0.00 23.12 19.50 1xle s ALA 47 CO 0.00 -1.71 0.34 0.98 0.00 0.00 0.00 175.76 175.37 1xle n TYR 48 N -2.84 0.52 -3.83 0.00 9.36 0.12 -4.64 117.16 115.85 1xle n TYR 48 Ca 0.12 0.18 -0.06 0.00 3.32 0.00 0.00 57.90 61.45 1xle n TYR 48 Cb 0.51 -1.09 0.00 0.00 -0.63 0.00 0.00 39.34 38.13 1xle n TYR 48 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 1xle s GLY 49 N -5.37 0.08 0.03 2.98 0.00 -1.20 -2.22 107.32 101.61 1xle s GLY 49 Ca -0.09 -0.39 0.01 0.00 0.00 0.00 0.00 44.72 44.25 1xle s GLY 49 CO 0.81 0.26 -0.05 -1.50 0.00 0.00 0.00 173.10 172.63 1xle s ILE 50 N -2.95 0.27 0.22 0.90 2.07 -0.58 -2.93 121.20 118.21 1xle s ILE 50 Ca 0.15 -0.88 0.08 0.00 -1.41 0.00 0.00 60.65 58.59 1xle s ILE 50 Cb -0.04 -0.37 -0.05 0.00 0.13 0.00 0.00 42.46 42.13 1xle s ILE 50 CO 0.07 -0.40 -0.14 0.42 -1.91 0.00 0.00 174.94 172.99 1xle s THR 51 N -1.27 1.78 0.16 4.00 -4.23 -0.95 -3.75 115.64 111.37 1xle s THR 51 Ca -0.12 -2.22 -0.20 0.00 -1.18 0.00 0.00 61.69 57.97 1xle s THR 51 Cb -0.09 -2.12 0.05 0.00 1.34 0.00 0.00 72.50 71.69 1xle s THR 51 CO -0.00 -0.54 0.55 0.72 -0.54 0.00 0.00 174.62 174.80 1xle s PHE 52 N -2.95 -0.37 0.11 3.99 -0.12 -1.23 -1.57 117.98 115.84 1xle s PHE 52 Ca 0.24 0.10 -0.05 0.00 -0.05 0.00 0.00 56.93 57.17 1xle s PHE 52 Cb -0.00 0.47 -0.05 0.00 -0.63 0.00 0.00 43.02 42.80 1xle s PHE 52 CO 0.08 -0.84 0.34 -1.01 -0.05 0.00 0.00 175.22 173.74 1xle s HIS 53 N -3.79 3.51 0.14 3.49 3.76 -1.25 -0.66 115.29 120.50 1xle s HIS 53 Ca 0.03 0.54 -0.25 0.00 -0.15 0.00 0.00 55.06 55.24 1xle s HIS 53 Cb -0.01 -1.98 0.00 0.00 1.11 0.00 0.00 32.58 31.70 1xle s HIS 53 CO -0.10 0.49 1.61 0.38 -0.85 0.00 0.00 174.74 176.27 1xle h ASP 54 N 3.12 -0.95 0.51 1.40 2.03 -1.69 -1.86 116.42 118.98 1xle h ASP 54 Ca -0.47 0.15 0.00 0.00 -0.73 0.00 0.00 57.03 55.98 1xle h ASP 54 Cb 1.17 0.42 0.00 0.00 -0.83 0.00 0.00 39.33 40.09 1xle h ASP 54 CO 0.71 -0.33 0.00 0.59 -1.03 0.00 0.00 179.24 179.18 1xle n ASN 55 N -5.40 0.22 -0.16 4.15 5.03 -1.24 -0.30 115.26 117.56 1xle n ASN 55 Ca -0.02 0.56 -0.09 0.00 0.87 0.00 0.00 54.58 55.90 1xle n ASN 55 Cb 0.32 -0.60 0.00 0.00 -1.02 0.00 0.00 39.78 38.47 1xle n ASN 55 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.26 175.87 1xle h ASP 56 N 0.00 0.72 0.00 6.41 3.32 -1.75 -3.36 116.42 121.76 1xle h ASP 56 Ca 0.00 -0.24 -0.42 0.00 0.02 0.00 0.00 57.03 56.39 1xle h ASP 56 Cb 0.25 -0.19 -0.06 0.00 0.22 0.00 0.00 39.33 39.55 1xle h ASP 56 CO 0.00 0.78 -2.30 -0.11 -1.72 0.00 0.00 179.24 175.89 1xle n LEU 57 N -4.48 1.99 -4.29 1.55 7.94 -0.65 -4.91 117.00 114.15 1xle n LEU 57 Ca 0.01 0.33 -0.36 0.00 -1.11 0.00 0.00 56.01 54.88 1xle n LEU 57 Cb 0.23 -0.86 -0.13 0.00 0.53 0.00 0.00 43.42 43.19 1xle n LEU 57 CO 0.40 0.54 -0.33 -0.63 -1.11 0.00 0.00 177.39 176.25 1xle s ILE 58 N -2.48 3.53 0.67 1.96 1.01 0.58 -5.03 121.20 121.45 1xle s ILE 58 Ca -0.37 -0.78 -0.17 0.00 0.00 0.00 0.00 60.65 59.34 1xle s ILE 58 Cb 0.13 -2.79 -0.07 0.00 0.01 0.00 0.00 42.46 39.74 1xle s ILE 58 CO 0.52 0.16 0.43 -2.65 0.00 0.00 0.00 174.94 173.40 1xle n PRO 59 N 4.79 0.33 0.17 2.79 -0.02 -1.26 -3.63 135.00 138.18 1xle n PRO 59 Ca -0.16 0.14 0.03 0.00 -2.02 0.00 0.00 63.50 61.50 1xle n PRO 59 Cb 0.48 -1.70 0.41 0.00 -0.02 0.00 0.00 33.50 32.67 1xle n PRO 59 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1xle h PHE 60 N -0.18 0.11 0.00 6.00 3.04 -1.95 -2.79 116.94 121.17 1xle h PHE 60 Ca -0.45 -0.01 -0.12 0.00 3.98 0.00 0.00 57.97 61.37 1xle h PHE 60 Cb 1.37 -0.03 -0.02 0.00 2.56 0.00 0.00 35.95 39.83 1xle h PHE 60 CO 0.32 0.31 -0.87 0.22 -2.02 0.00 0.00 178.31 176.28 1xle h ASP 61 N 0.09 0.00 -0.91 0.41 1.82 -2.01 -3.48 116.42 112.34 1xle h ASP 61 Ca 0.02 0.00 -0.64 0.00 -0.39 0.00 0.00 57.03 56.02 1xle h ASP 61 Cb 0.44 0.00 0.09 0.00 0.68 0.00 0.00 39.33 40.54 1xle h ASP 61 CO 0.03 0.47 -0.35 0.00 -1.61 0.00 0.00 179.24 177.79 1xle n ALA 62 N -2.28 -2.87 -1.93 -0.78 0.00 -1.05 -4.95 120.51 106.64 1xle n ALA 62 Ca -0.02 0.44 -0.27 0.00 0.00 0.00 0.00 53.44 53.58 1xle n ALA 62 Cb 0.75 -1.50 0.10 0.00 0.00 0.00 0.00 19.45 18.80 1xle n ALA 62 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1xle s THR 63 N -0.68 2.16 0.18 0.00 -4.23 -1.26 -4.84 115.64 106.98 1xle s THR 63 Ca 0.64 -0.20 -0.13 0.00 -1.18 0.00 0.00 61.69 60.82 1xle s THR 63 Cb -0.92 -2.96 0.09 0.00 1.34 0.00 0.00 72.50 70.05 1xle s THR 63 CO 0.51 0.00 1.83 1.05 -0.54 0.00 0.00 174.62 177.47 1xle h GLU 64 N -0.87 0.80 -0.43 3.99 9.09 -1.99 0.22 114.58 125.39 1xle h GLU 64 Ca -0.44 -0.06 0.01 0.00 0.05 0.00 0.00 59.36 58.92 1xle h GLU 64 Cb 1.30 -0.17 -0.02 0.00 -1.65 0.00 0.00 28.75 28.20 1xle h GLU 64 CO 0.56 0.56 0.28 0.00 0.05 0.00 0.00 179.01 180.46 1xle h ALA 65 N 1.20 0.55 -0.65 1.06 0.00 -2.00 -1.83 119.26 117.59 1xle h ALA 65 Ca 0.22 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 1xle h ALA 65 Cb -0.05 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1xle h ALA 65 CO -0.04 -0.01 0.21 0.93 0.00 0.00 0.00 179.25 180.34 1xle h GLU 66 N 0.57 1.01 -0.19 0.00 5.08 -1.73 -1.61 114.58 117.71 1xle h GLU 66 Ca 0.16 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1xle h GLU 66 Cb -0.05 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 1xle h GLU 66 CO -0.04 0.88 0.12 -0.09 -1.00 0.00 0.00 179.01 178.88 1xle h ARG 67 N 0.94 0.25 -0.36 2.33 2.43 -0.14 -2.28 114.38 117.55 1xle h ARG 67 Ca 0.21 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.26 1xle h ARG 67 Cb 0.28 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1xle h ARG 67 CO -0.01 0.17 -0.21 0.93 -1.51 0.00 0.00 179.97 179.35 1xle h GLU 68 N 0.25 0.70 0.39 0.20 4.39 -1.27 -1.87 114.58 117.37 1xle h GLU 68 Ca 0.07 -0.26 -0.01 0.00 0.34 0.00 0.00 59.36 59.50 1xle h GLU 68 Cb -0.02 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.56 1xle h GLU 68 CO -0.01 0.85 -0.50 -0.22 -1.16 0.00 0.00 179.01 177.97 1xle h LYS 69 N 0.61 -0.88 -0.61 2.33 3.64 -1.08 -1.92 116.57 118.65 1xle h LYS 69 Ca 0.09 0.06 0.13 0.00 -1.27 0.00 0.00 60.65 59.66 1xle h LYS 69 Cb 0.69 0.20 -0.10 0.00 -0.41 0.00 0.00 32.23 32.60 1xle h LYS 69 CO 0.05 -0.59 0.01 0.82 -2.27 0.00 0.00 179.45 177.47 1xle h ILE 70 N -0.92 0.50 0.00 2.00 2.04 -1.28 -1.69 117.51 118.15 1xle h ILE 70 Ca -0.04 -0.04 -0.05 0.00 1.00 0.00 0.00 64.86 65.73 1xle h ILE 70 Cb 0.83 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 1xle h ILE 70 CO -0.12 0.02 -0.23 -0.07 0.00 0.00 0.00 178.15 177.75 1xle h LEU 71 N 0.12 0.00 0.29 1.44 3.38 -1.18 -0.55 115.31 118.81 1xle h LEU 71 Ca 0.32 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.28 1xle h LEU 71 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1xle h LEU 71 CO -0.52 0.23 -0.14 1.23 0.09 0.00 0.00 178.44 179.33 1xle h GLY 72 N 0.73 -0.40 0.99 0.83 0.00 -0.49 0.29 103.07 105.02 1xle h GLY 72 Ca -0.00 0.15 -0.03 0.00 0.00 0.00 0.00 47.33 47.45 1xle h GLY 72 CO 0.03 -0.15 0.26 -0.55 0.00 0.00 0.00 176.54 176.13 1xle h ASP 73 N -0.73 0.79 0.45 0.19 3.32 -1.44 0.24 116.42 119.25 1xle h ASP 73 Ca -0.04 -0.15 -0.02 0.00 0.02 0.00 0.00 57.03 56.84 1xle h ASP 73 Cb 0.49 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1xle h ASP 73 CO 0.06 0.72 -0.22 0.15 -1.72 0.00 0.00 179.24 178.24 1xle h PHE 74 N 0.81 -0.56 -0.09 4.55 3.57 -1.10 -2.61 116.94 121.51 1xle h PHE 74 Ca 0.20 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 1xle h PHE 74 Cb 0.16 0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 1xle h PHE 74 CO 0.00 -0.32 -0.02 -0.91 -2.23 0.00 0.00 178.31 174.84 1xle h ASN 75 N -0.67 0.11 -0.65 0.41 4.21 -0.16 -1.80 115.58 117.02 1xle h ASN 75 Ca -0.06 -0.01 -0.06 0.00 1.21 0.00 0.00 56.30 57.38 1xle h ASN 75 Cb 0.50 -0.03 -0.03 0.00 -1.12 0.00 0.00 38.32 37.65 1xle h ASN 75 CO 0.10 0.15 0.18 -0.61 -1.29 0.00 0.00 177.43 175.96 1xle h GLN 76 N 0.12 1.02 -0.45 0.81 5.75 -0.83 -1.89 115.11 119.64 1xle h GLN 76 Ca 0.03 -0.23 -0.04 0.00 -0.15 0.00 0.00 58.65 58.26 1xle h GLN 76 Cb 0.12 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.51 1xle h GLN 76 CO 0.00 0.91 0.14 0.00 -2.65 0.00 0.00 178.83 177.23 1xle h ALA 77 N 1.07 0.60 -0.03 3.38 0.00 -1.07 0.91 119.26 124.11 1xle h ALA 77 Ca 0.21 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1xle h ALA 77 Cb 0.33 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1xle h ALA 77 CO -0.00 0.25 0.02 -0.07 0.00 0.00 0.00 179.25 179.45 1xle h LEU 78 N 0.60 0.04 0.04 0.00 3.38 -1.25 -0.50 115.31 117.62 1xle h LEU 78 Ca 0.15 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.12 1xle h LEU 78 Cb 0.28 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1xle h LEU 78 CO -0.00 0.03 -0.11 0.11 0.09 0.00 0.00 178.44 178.56 1xle h LYS 79 N 0.04 -0.20 -0.94 1.13 1.57 -0.94 0.76 116.57 117.99 1xle h LYS 79 Ca 0.01 0.01 0.06 0.00 -1.87 0.00 0.00 60.65 58.86 1xle h LYS 79 Cb -0.00 0.04 -0.06 0.00 0.08 0.00 0.00 32.23 32.29 1xle h LYS 79 CO -0.00 -0.13 0.61 -0.44 -0.57 0.00 0.00 179.45 178.92 1xle h ASP 80 N -0.21 0.97 0.12 0.86 5.19 0.12 -3.24 116.42 120.24 1xle h ASP 80 Ca 0.03 0.00 -0.27 0.00 -0.62 0.00 0.00 57.03 56.17 1xle h ASP 80 Cb 0.23 -0.21 -0.05 0.00 0.18 0.00 0.00 39.33 39.48 1xle h ASP 80 CO -0.08 0.64 -2.15 0.35 -3.12 0.00 0.00 179.24 174.88 1xle n THR 81 N -4.48 1.13 -0.08 0.35 -2.24 -0.23 -5.03 114.28 103.71 1xle n THR 81 Ca 0.14 -0.77 0.00 0.00 -2.27 0.00 0.00 64.05 61.15 1xle n THR 81 Cb 0.16 -0.46 0.00 0.00 -2.10 0.00 0.00 70.33 67.94 1xle n THR 81 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xle n GLY 82 N 1.60 0.56 3.77 3.38 0.00 0.26 -4.99 105.19 109.78 1xle n GLY 82 Ca -0.24 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.41 1xle n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xle s LEU 83 N 0.00 3.96 0.67 0.99 1.43 -1.20 -4.95 118.68 119.58 1xle s LEU 83 Ca 0.00 2.38 -0.02 0.00 -1.03 0.00 0.00 54.13 55.46 1xle s LEU 83 Cb 0.00 -4.27 0.08 0.00 0.03 0.00 0.00 46.19 42.03 1xle s LEU 83 CO 0.00 -1.07 0.94 -0.54 0.23 0.00 0.00 176.35 175.91 1xle s LYS 84 N -2.78 2.05 -0.54 1.70 -0.14 -0.94 -4.79 119.74 114.30 1xle s LYS 84 Ca 0.66 -0.73 0.05 0.00 -1.36 0.00 0.00 55.97 54.58 1xle s LYS 84 Cb -0.30 -2.31 0.17 0.00 -1.68 0.00 0.00 37.83 33.70 1xle s LYS 84 CO 0.37 -1.19 0.42 0.28 -0.76 0.00 0.00 175.35 174.46 1xle n VAL 85 N -2.74 0.10 0.18 3.17 0.31 -1.26 -1.52 118.33 116.57 1xle n VAL 85 Ca 0.11 -4.10 0.05 0.00 -0.01 0.00 0.00 64.34 60.38 1xle n VAL 85 Cb 0.60 -1.90 0.27 0.00 -0.91 0.00 0.00 33.84 31.90 1xle n VAL 85 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1xle h PRO 86 N 5.44 0.00 -3.87 5.55 0.11 -1.87 -2.93 132.00 134.43 1xle h PRO 86 Ca 0.21 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 66.14 1xle h PRO 86 Cb 0.84 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 31.72 1xle h PRO 86 CO 0.53 0.42 -0.68 1.41 -0.21 0.00 0.00 178.00 179.47 1xle s MET 87 N -3.48 0.24 0.07 1.05 -2.45 -1.26 -1.80 119.30 111.67 1xle s MET 87 Ca 0.01 -0.42 0.05 0.00 -1.25 0.00 0.00 55.69 54.07 1xle s MET 87 Cb 0.10 0.09 -0.03 0.00 1.25 0.00 0.00 34.83 36.25 1xle s MET 87 CO 0.70 -0.04 -0.14 0.08 1.05 0.00 0.00 175.02 176.67 1xle s VAL 88 N -1.06 1.08 0.15 10.11 1.01 -0.99 -3.50 120.40 127.20 1xle s VAL 88 Ca -0.12 -1.29 -0.08 0.00 0.00 0.00 0.00 61.98 60.49 1xle s VAL 88 Cb -0.07 -1.04 -0.01 0.00 0.00 0.00 0.00 36.38 35.25 1xle s VAL 88 CO -0.01 -0.23 0.25 0.28 0.00 0.00 0.00 175.10 175.39 1xle s THR 89 N -1.28 0.08 0.05 3.92 -1.32 0.17 -1.15 115.64 116.11 1xle s THR 89 Ca -0.02 -1.37 0.04 0.00 -1.21 0.00 0.00 61.69 59.12 1xle s THR 89 Cb -0.10 -1.75 -0.04 0.00 -1.51 0.00 0.00 72.50 69.11 1xle s THR 89 CO 0.02 -0.38 -0.04 -0.89 -2.21 0.00 0.00 174.62 171.12 1xle s THR 90 N -3.95 3.78 -0.39 5.08 2.01 -1.26 -1.79 115.64 119.12 1xle s THR 90 Ca 0.15 -0.91 -0.22 0.00 0.31 0.00 0.00 61.69 61.03 1xle s THR 90 Cb 0.04 -2.72 0.01 0.00 0.01 0.00 0.00 72.50 69.84 1xle s THR 90 CO -0.02 0.26 0.70 0.21 -0.69 0.00 0.00 174.62 175.07 1xle s ASN 91 N -1.85 6.44 -0.22 3.53 3.84 -1.26 -4.86 114.94 120.56 1xle s ASN 91 Ca 0.21 0.07 0.12 0.00 0.21 0.00 0.00 52.86 53.47 1xle s ASN 91 Cb -0.11 -2.35 0.44 0.00 -0.55 0.00 0.00 41.25 38.68 1xle s ASN 91 CO 0.12 -0.72 1.20 0.18 -2.79 0.00 0.00 177.10 175.09 1xle n LEU 92 N 6.30 3.19 0.00 3.21 4.77 -1.26 -4.80 117.00 128.40 1xle n LEU 92 Ca 0.00 -3.91 0.00 0.00 -0.03 0.00 0.00 56.01 52.07 1xle n LEU 92 Cb 0.48 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1xle n LEU 92 CO 0.53 1.52 0.00 2.22 -1.33 0.00 0.00 177.39 180.33 1xle n PHE 93 N -0.76 0.00 -0.02 -1.77 1.16 -1.26 -4.48 117.46 110.33 1xle n PHE 93 Ca 0.25 0.00 -0.21 0.00 -1.87 0.00 0.00 57.45 55.62 1xle n PHE 93 Cb 0.85 0.00 -0.13 0.00 -1.61 0.00 0.00 39.48 38.58 1xle n PHE 93 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 1xle h SER 94 N 0.00 0.28 -3.55 5.98 0.02 -1.93 -3.46 113.55 110.88 1xle h SER 94 Ca 0.00 -0.80 -0.53 0.00 -0.84 0.00 0.00 61.79 59.61 1xle h SER 94 Cb 0.00 -0.09 0.09 0.00 0.14 0.00 0.00 62.40 62.54 1xle h SER 94 CO 0.00 1.57 0.86 -2.28 -1.14 0.00 0.00 176.83 175.83 1xle s HIS 95 N -2.44 2.67 0.60 3.45 2.46 -1.26 -4.86 115.29 115.90 1xle s HIS 95 Ca -0.22 0.90 0.29 0.00 0.47 0.00 0.00 55.06 56.51 1xle s HIS 95 Cb 0.04 -4.07 1.30 0.00 -0.13 0.00 0.00 32.58 29.72 1xle s HIS 95 CO 0.73 -3.45 1.68 -1.35 -2.47 0.00 0.00 174.74 169.88 1xle h PRO 96 N 4.15 0.00 -0.48 2.88 0.11 -2.02 -0.40 132.00 136.24 1xle h PRO 96 Ca -0.49 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.64 1xle h PRO 96 Cb 1.23 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 1xle h PRO 96 CO 0.74 0.00 0.32 -0.24 -0.21 0.00 0.00 178.00 178.61 1xle h VAL 97 N 0.00 1.09 -0.40 3.15 3.04 -1.97 -2.60 116.25 118.56 1xle h VAL 97 Ca 0.34 -0.21 -0.14 0.00 -1.01 0.00 0.00 66.70 65.68 1xle h VAL 97 Cb 1.90 0.43 -0.08 0.00 -2.01 0.00 0.00 31.29 31.53 1xle h VAL 97 CO -0.00 0.11 0.18 0.49 -1.01 0.00 0.00 177.57 177.34 1xle n PHE 98 N -4.47 1.31 0.28 3.17 3.72 -0.16 -4.57 117.46 116.75 1xle n PHE 98 Ca 0.05 -0.80 0.14 0.00 -0.05 0.00 0.00 57.45 56.78 1xle n PHE 98 Cb 0.09 -0.47 0.82 0.00 -0.94 0.00 0.00 39.48 38.98 1xle n PHE 98 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1xle h LYS 99 N 1.19 0.00 -0.15 -1.08 2.10 -1.64 -1.93 116.57 115.05 1xle h LYS 99 Ca 0.17 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.82 1xle h LYS 99 Cb 1.62 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.95 1xle h LYS 99 CO 0.41 0.07 0.00 -3.47 -2.00 0.00 0.00 179.45 174.46 1xle n ASP 100 N -3.74 2.29 0.00 7.07 2.03 -1.26 -5.06 116.55 117.88 1xle n ASP 100 Ca -0.02 -1.81 0.00 0.00 0.52 0.00 0.00 54.79 53.48 1xle n ASP 100 Cb 0.17 -0.10 0.00 0.00 -0.72 0.00 0.00 41.12 40.46 1xle n ASP 100 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xle n GLY 101 N 0.18 0.97 0.00 0.27 0.00 -0.73 -3.77 105.19 102.11 1xle n GLY 101 Ca 0.06 -2.26 0.00 0.00 0.00 0.00 0.00 46.02 43.82 1xle n GLY 101 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xle n GLY 102 N -1.18 0.05 0.42 -0.02 0.00 -1.26 -4.38 105.19 98.82 1xle n GLY 102 Ca 0.00 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.25 1xle n GLY 102 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1xle h PHE 103 N 0.00 0.13 -0.14 1.61 0.04 -1.87 -2.56 116.94 114.14 1xle h PHE 103 Ca 0.00 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 1xle h PHE 103 Cb 0.00 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.10 1xle h PHE 103 CO 0.00 0.04 -0.05 0.25 -0.60 0.00 0.00 178.31 177.95 1xle n THR 104 N -4.36 2.15 -1.82 -1.55 -2.24 -1.26 -4.36 114.28 100.83 1xle n THR 104 Ca 0.15 -2.24 -0.41 0.00 -2.27 0.00 0.00 64.05 59.28 1xle n THR 104 Cb 0.75 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 1xle n THR 104 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1xle s SER 105 N -2.50 6.23 0.26 3.42 0.15 -0.96 -4.81 113.70 115.49 1xle s SER 105 Ca 0.38 2.99 -0.00 0.00 0.70 0.00 0.00 55.95 60.02 1xle s SER 105 Cb 0.33 -2.66 0.34 0.00 -1.71 0.00 0.00 66.02 62.31 1xle s SER 105 CO 0.04 -0.95 1.71 0.78 1.20 0.00 0.00 173.24 176.03 1xle h ASN 106 N 2.82 0.63 -2.79 5.45 2.35 -1.92 -3.41 115.58 118.71 1xle h ASN 106 Ca -0.51 -0.20 -0.56 0.00 -0.55 0.00 0.00 56.30 54.49 1xle h ASN 106 Cb 1.25 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 39.42 1xle h ASN 106 CO 0.63 0.81 1.02 -0.62 -1.65 0.00 0.00 177.43 177.62 1xle s ASP 107 N -6.75 6.72 0.28 5.81 -1.08 -1.26 -4.94 116.67 115.44 1xle s ASP 107 Ca -0.08 1.85 0.00 0.00 -0.52 0.00 0.00 52.55 53.80 1xle s ASP 107 Cb 0.14 -2.54 0.40 0.00 -1.46 0.00 0.00 42.92 39.46 1xle s ASP 107 CO 0.81 -0.94 1.77 -0.09 0.52 0.00 0.00 175.17 177.24 1xle h ARG 108 N 9.24 0.68 -0.06 4.34 2.43 -2.00 -1.98 114.38 127.04 1xle h ARG 108 Ca -0.32 -0.19 -0.09 0.00 -0.81 0.00 0.00 59.98 58.57 1xle h ARG 108 Cb 1.14 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.60 1xle h ARG 108 CO 0.97 0.73 -0.36 0.66 -1.51 0.00 0.00 179.97 180.47 1xle h SER 109 N 0.64 0.11 0.48 -3.80 4.64 -1.95 -1.77 113.55 111.90 1xle h SER 109 Ca 0.12 -0.04 -0.20 0.00 -0.47 0.00 0.00 61.79 61.20 1xle h SER 109 Cb 0.47 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.52 1xle h SER 109 CO 0.02 0.47 -0.86 0.40 -0.87 0.00 0.00 176.83 175.99 1xle h ILE 110 N 0.10 1.45 -0.35 0.95 2.04 -1.88 -2.40 117.51 117.42 1xle h ILE 110 Ca 0.01 -2.49 0.01 0.00 1.00 0.00 0.00 64.86 63.39 1xle h ILE 110 Cb 0.68 2.39 -0.02 0.00 -0.74 0.00 0.00 36.82 39.13 1xle h ILE 110 CO 0.05 0.73 0.21 0.03 0.00 0.00 0.00 178.15 179.18 1xle h ARG 111 N 0.16 0.43 -0.36 2.37 3.08 -0.56 0.34 114.38 119.83 1xle h ARG 111 Ca -0.05 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 1xle h ARG 111 Cb 1.48 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 31.41 1xle h ARG 111 CO 0.14 0.28 0.20 0.00 -1.07 0.00 0.00 179.97 179.52 1xle h ARG 112 N 0.44 0.51 0.16 0.04 3.08 -1.50 -1.87 114.38 115.24 1xle h ARG 112 Ca 0.13 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1xle h ARG 112 Cb -0.02 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 29.93 1xle h ARG 112 CO -0.05 0.42 -0.08 0.35 -1.07 0.00 0.00 179.97 179.54 1xle h PHE 113 N 0.46 -0.20 -0.87 3.04 3.57 -1.06 0.20 116.94 122.08 1xle h PHE 113 Ca 0.13 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.65 1xle h PHE 113 Cb 0.06 0.07 -0.05 0.00 2.79 0.00 0.00 35.95 38.82 1xle h PHE 113 CO -0.03 -0.08 0.57 0.00 -2.23 0.00 0.00 178.31 176.54 1xle h ALA 114 N 0.55 1.13 -0.38 2.41 0.00 -0.19 -1.06 119.26 121.72 1xle h ALA 114 Ca -0.02 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1xle h ALA 114 Cb 0.22 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1xle h ALA 114 CO 0.04 0.45 0.06 1.25 0.00 0.00 0.00 179.25 181.05 1xle h LEU 115 N 1.13 0.61 -1.14 0.00 5.85 -1.26 -2.35 115.31 118.15 1xle h LEU 115 Ca 0.34 -0.26 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 1xle h LEU 115 Cb -0.05 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 1xle h LEU 115 CO -0.10 0.71 -0.32 0.00 -0.34 0.00 0.00 178.44 178.40 1xle h ALA 116 N 0.92 1.28 -0.83 1.25 0.00 0.00 0.77 119.26 122.65 1xle h ALA 116 Ca 0.12 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1xle h ALA 116 Cb 0.36 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1xle h ALA 116 CO 0.01 0.50 0.40 -0.22 0.00 0.00 0.00 179.25 179.93 1xle h LYS 117 N 0.17 1.19 -0.00 0.00 3.64 -1.06 -2.86 116.57 117.64 1xle h LYS 117 Ca 0.02 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 59.23 1xle h LYS 117 Cb 0.65 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 32.26 1xle h LYS 117 CO 0.05 0.91 -0.00 0.28 -2.27 0.00 0.00 179.45 178.42 1xle h VAL 118 N 1.18 1.29 -0.85 2.00 2.07 -0.66 -2.90 116.25 118.38 1xle h VAL 118 Ca 0.29 -0.85 0.02 0.00 0.82 0.00 0.00 66.70 66.97 1xle h VAL 118 Cb 0.12 1.86 -0.05 0.00 -1.52 0.00 0.00 31.29 31.70 1xle h VAL 118 CO -0.04 0.22 0.55 -0.07 0.02 0.00 0.00 177.57 178.26 1xle h LEU 119 N -0.35 0.93 -1.19 2.57 3.38 -0.81 -0.78 115.31 119.07 1xle h LEU 119 Ca 0.00 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1xle h LEU 119 Cb 0.36 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1xle h LEU 119 CO 0.00 0.66 0.02 0.45 0.09 0.00 0.00 178.44 179.66 1xle h HIS 120 N 1.10 0.60 0.00 1.13 3.86 -1.54 -2.27 115.15 118.02 1xle h HIS 120 Ca 0.33 -0.06 -0.11 0.00 -1.16 0.00 0.00 60.37 59.37 1xle h HIS 120 Cb -0.05 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 28.23 1xle h HIS 120 CO -0.02 0.57 -0.51 -0.97 0.86 0.00 0.00 177.93 177.86 1xle h ASN 121 N 0.55 0.00 -0.38 2.45 -1.24 -1.25 -2.15 115.58 113.56 1xle h ASN 121 Ca 0.12 0.00 -0.11 0.00 0.71 0.00 0.00 56.30 57.02 1xle h ASN 121 Cb 0.33 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.37 1xle h ASN 121 CO 0.01 0.51 -0.18 0.40 -1.29 0.00 0.00 177.43 176.88 1xle h ILE 122 N 0.00 1.28 0.11 2.57 2.04 -0.56 -0.06 117.51 122.89 1xle h ILE 122 Ca -0.01 -1.30 -0.01 0.00 1.00 0.00 0.00 64.86 64.54 1xle h ILE 122 Cb 1.14 1.31 0.00 0.00 -0.74 0.00 0.00 36.82 38.53 1xle h ILE 122 CO 0.07 0.43 -0.06 0.44 0.00 0.00 0.00 178.15 179.03 1xle h ASP 123 N 0.59 -0.13 -0.60 1.72 3.32 -1.25 -1.28 116.42 118.79 1xle h ASP 123 Ca 0.09 -0.09 0.03 0.00 0.02 0.00 0.00 57.03 57.07 1xle h ASP 123 Cb 0.73 0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.27 1xle h ASP 123 CO 0.05 0.01 0.36 0.25 -1.72 0.00 0.00 179.24 178.20 1xle h LEU 124 N -0.27 0.59 -0.23 1.55 5.85 -1.35 -1.11 115.31 120.34 1xle h LEU 124 Ca -0.02 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.76 1xle h LEU 124 Cb 0.22 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.08 1xle h LEU 124 CO 0.03 0.41 -0.07 0.00 -0.34 0.00 0.00 178.44 178.46 1xle h ALA 125 N 1.26 0.13 0.21 1.25 0.00 -0.56 -0.59 119.26 120.96 1xle h ALA 125 Ca 0.24 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.25 1xle h ALA 125 Cb 0.03 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1xle h ALA 125 CO -0.10 -0.49 -0.26 0.00 0.00 0.00 0.00 179.25 178.40 1xle h ALA 126 N 1.20 -0.50 -0.97 0.00 0.00 -1.03 -2.67 119.26 115.29 1xle h ALA 126 Ca 0.11 -0.07 0.21 0.00 0.00 0.00 0.00 54.91 55.16 1xle h ALA 126 Cb 0.20 0.38 -0.11 0.00 0.00 0.00 0.00 17.79 18.25 1xle h ALA 126 CO -0.25 -0.82 0.55 1.49 0.00 0.00 0.00 179.25 180.23 1xle h GLU 127 N -0.52 0.62 0.00 0.00 4.81 -0.15 -0.73 114.58 118.61 1xle h GLU 127 Ca 0.01 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1xle h GLU 127 Cb 0.50 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.74 1xle h GLU 127 CO -0.09 0.41 0.00 -1.33 -0.73 0.00 0.00 179.01 177.27 1xle n MET 128 N -4.86 0.02 -0.76 1.92 2.81 -0.33 -4.95 117.12 110.97 1xle n MET 128 Ca 0.23 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 56.15 1xle n MET 128 Cb 0.62 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.63 1xle n MET 128 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xle n GLY 129 N 1.32 0.59 3.77 3.03 0.00 -0.28 -4.58 105.19 109.03 1xle n GLY 129 Ca 0.07 -0.28 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 1xle n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xle s ALA 130 N -2.00 3.40 -0.34 4.61 0.00 -1.08 -4.79 121.76 121.56 1xle s ALA 130 Ca 0.00 1.13 0.20 0.00 0.00 0.00 0.00 51.96 53.29 1xle s ALA 130 Cb 0.00 -3.43 -0.28 0.00 0.00 0.00 0.00 23.12 19.41 1xle s ALA 130 CO 0.00 -0.54 0.58 0.39 0.00 0.00 0.00 175.76 176.19 1xle n GLU 131 N 0.69 0.57 -4.88 0.00 -0.58 -0.75 -4.65 120.64 111.04 1xle n GLU 131 Ca 0.01 -0.12 -0.26 0.00 -0.42 0.00 0.00 57.16 56.37 1xle n GLU 131 Cb 0.43 -1.47 -0.16 0.00 -0.57 0.00 0.00 31.44 29.68 1xle n GLU 131 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1xle s THR 132 N -3.22 1.47 -0.31 2.62 2.01 -1.11 -1.69 115.64 115.41 1xle s THR 132 Ca -0.02 -0.77 -0.04 0.00 0.31 0.00 0.00 61.69 61.17 1xle s THR 132 Cb 0.14 -1.25 0.04 0.00 0.01 0.00 0.00 72.50 71.44 1xle s THR 132 CO 0.83 0.42 0.04 0.12 -0.69 0.00 0.00 174.62 175.34 1xle s PHE 133 N -0.18 3.24 0.21 4.92 5.36 0.12 -2.34 117.98 129.31 1xle s PHE 133 Ca 0.01 -1.64 -0.13 0.00 -0.96 0.00 0.00 56.93 54.22 1xle s PHE 133 Cb -0.10 -2.17 -0.07 0.00 -0.34 0.00 0.00 43.02 40.34 1xle s PHE 133 CO 0.01 -0.76 0.59 0.08 -1.46 0.00 0.00 175.22 173.68 1xle s VAL 134 N 1.33 4.84 -0.30 3.12 1.01 -0.30 -1.61 120.40 128.50 1xle s VAL 134 Ca -0.03 0.72 0.01 0.00 0.00 0.00 0.00 61.98 62.68 1xle s VAL 134 Cb -0.19 -3.67 0.09 0.00 0.00 0.00 0.00 36.38 32.60 1xle s VAL 134 CO 0.00 0.04 0.05 -0.04 0.00 0.00 0.00 175.10 175.15 1xle s MET 135 N -2.48 1.13 -0.39 2.72 -1.94 -0.36 -4.20 119.30 113.79 1xle s MET 135 Ca 0.45 -1.26 -0.09 0.00 -1.71 0.00 0.00 55.69 53.07 1xle s MET 135 Cb -0.13 -2.48 0.05 0.00 2.01 0.00 0.00 34.83 34.28 1xle s MET 135 CO 0.20 -0.87 0.21 -0.46 -0.01 0.00 0.00 175.02 174.08 1xle s TRP 136 N 1.37 3.28 -1.48 -0.03 -0.00 -1.26 -1.60 118.94 119.22 1xle s TRP 136 Ca 0.06 -1.28 -0.09 0.00 -0.00 0.00 0.00 56.10 54.79 1xle s TRP 136 Cb -0.18 -2.61 0.02 0.00 -0.00 0.00 0.00 33.47 30.69 1xle s TRP 136 CO -0.15 -0.75 2.59 0.41 -0.00 0.00 0.00 176.95 179.05 1xle n GLY 137 N 4.93 4.61 0.27 5.86 0.00 -1.26 -4.79 105.19 114.81 1xle n GLY 137 Ca -0.11 -1.73 0.13 0.00 0.00 0.00 0.00 46.02 44.30 1xle n GLY 137 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1xle h GLY 138 N 7.10 0.00 -1.51 -0.02 0.00 -1.91 -3.00 103.07 103.73 1xle h GLY 138 Ca 0.74 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.07 1xle h GLY 138 CO 1.70 0.00 0.00 0.54 0.00 0.00 0.00 176.54 178.78 1xle n ARG 139 N -3.73 1.93 -2.58 4.80 5.12 -1.26 -3.91 116.66 117.03 1xle n ARG 139 Ca -0.02 -1.82 -0.42 0.00 -1.93 0.00 0.00 57.85 53.66 1xle n ARG 139 Cb 0.21 -1.34 -0.03 0.00 -1.16 0.00 0.00 32.46 30.14 1xle n ARG 139 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1xle s GLU 140 N -1.17 3.33 0.00 5.56 0.41 -1.14 -3.23 118.70 122.46 1xle s GLU 140 Ca 0.25 -0.05 0.00 0.00 -0.41 0.00 0.00 54.97 54.75 1xle s GLU 140 Cb 0.15 -4.11 0.00 0.00 -1.78 0.00 0.00 34.13 28.39 1xle s GLU 140 CO 0.21 -1.92 0.00 0.41 -0.49 0.00 0.00 175.26 173.46 1xle n GLY 141 N 5.24 -0.56 3.62 -1.39 0.00 -1.26 -1.16 105.19 109.68 1xle n GLY 141 Ca 0.05 -0.76 -0.09 0.00 0.00 0.00 0.00 46.02 45.22 1xle n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xle s SER 142 N -4.00 -0.40 -0.15 1.61 1.04 -0.62 -4.97 113.70 106.21 1xle s SER 142 Ca 0.00 -0.26 0.16 0.00 0.48 0.00 0.00 55.95 56.33 1xle s SER 142 Cb 0.00 0.61 -0.24 0.00 0.10 0.00 0.00 66.02 66.49 1xle s SER 142 CO 0.00 -1.06 0.25 -0.62 0.98 0.00 0.00 173.24 172.80 1xle n GLU 143 N -0.40 0.67 -4.98 4.02 4.71 -1.26 -1.91 120.64 121.49 1xle n GLU 143 Ca -0.10 0.09 -0.32 0.00 -0.01 0.00 0.00 57.16 56.81 1xle n GLU 143 Cb 0.62 -1.61 -0.14 0.00 -1.01 0.00 0.00 31.44 29.31 1xle n GLU 143 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 1xle s TYR 144 N -2.52 2.62 0.18 -0.32 2.02 -1.26 -4.91 117.35 113.16 1xle s TYR 144 Ca -0.09 -0.22 0.28 0.00 -0.37 0.00 0.00 57.07 56.68 1xle s TYR 144 Cb 0.07 -1.60 1.20 0.00 -0.40 0.00 0.00 41.96 41.23 1xle s TYR 144 CO 0.83 0.14 1.93 -0.44 -1.57 0.00 0.00 175.55 176.44 1xle h ASP 145 N 5.37 0.00 -0.03 2.29 3.32 -1.98 -3.18 116.42 122.21 1xle h ASP 145 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1xle h ASP 145 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 1xle h ASP 145 CO 0.50 0.12 0.00 0.61 -1.72 0.00 0.00 179.24 178.75 1xle n GLY 146 N -0.05 0.13 0.27 2.75 0.00 -1.26 -4.37 105.19 102.67 1xle n GLY 146 Ca -0.00 -0.47 0.12 0.00 0.00 0.00 0.00 46.02 45.67 1xle n GLY 146 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1xle h SER 147 N 2.62 0.00 -4.52 1.61 0.02 -1.99 -3.45 113.55 107.84 1xle h SER 147 Ca 0.00 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.63 1xle h SER 147 Cb 0.56 0.00 -0.19 0.00 0.14 0.00 0.00 62.40 62.90 1xle h SER 147 CO 0.00 0.07 -0.74 -0.54 -1.14 0.00 0.00 176.83 174.48 1xle s LYS 148 N -4.51 0.75 -0.43 3.45 -0.14 -1.26 -5.04 119.74 112.56 1xle s LYS 148 Ca -0.04 -1.02 -0.17 0.00 -1.36 0.00 0.00 55.97 53.37 1xle s LYS 148 Cb 0.15 -0.50 0.03 0.00 -1.68 0.00 0.00 37.83 35.83 1xle s LYS 148 CO 0.59 0.08 0.46 0.34 -0.76 0.00 0.00 175.35 176.06 1xle s ASP 149 N -2.12 6.20 0.20 2.83 -1.08 -1.26 -4.96 116.67 116.48 1xle s ASP 149 Ca 0.00 -0.71 -0.11 0.00 -0.52 0.00 0.00 52.55 51.21 1xle s ASP 149 Cb -0.06 -2.23 0.14 0.00 -1.46 0.00 0.00 42.92 39.31 1xle s ASP 149 CO 0.00 -0.62 1.87 -0.07 0.52 0.00 0.00 175.17 176.88 1xle h LEU 150 N 9.12 0.82 -0.28 -1.34 3.38 -1.99 0.71 115.31 125.74 1xle h LEU 150 Ca -0.26 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 1xle h LEU 150 Cb 1.11 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 1xle h LEU 150 CO 0.82 0.60 0.11 0.00 0.09 0.00 0.00 178.44 180.06 1xle h ALA 151 N 1.26 0.36 -0.10 1.53 0.00 -2.00 -2.86 119.26 117.46 1xle h ALA 151 Ca 0.26 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 1xle h ALA 151 Cb -0.11 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1xle h ALA 151 CO -0.06 -0.04 -0.28 0.00 0.00 0.00 0.00 179.25 178.88 1xle h ALA 152 N 0.95 1.36 -0.25 0.00 0.00 -1.91 -1.37 119.26 118.05 1xle h ALA 152 Ca 0.09 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1xle h ALA 152 Cb 0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1xle h ALA 152 CO -0.01 0.45 0.13 0.00 0.00 0.00 0.00 179.25 179.82 1xle h ALA 153 N 1.56 0.32 -0.37 0.00 0.00 -0.73 -0.69 119.26 119.36 1xle h ALA 153 Ca 0.02 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1xle h ALA 153 Cb 0.58 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1xle h ALA 153 CO 0.04 -0.13 -0.19 -0.07 0.00 0.00 0.00 179.25 178.91 1xle h LEU 154 N 0.28 0.70 -0.58 0.00 3.38 -1.23 -0.27 115.31 117.59 1xle h LEU 154 Ca 0.09 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 1xle h LEU 154 Cb 0.09 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1xle h LEU 154 CO -0.01 0.88 0.24 0.44 0.09 0.00 0.00 178.44 180.08 1xle h ASP 155 N 0.62 0.78 -0.23 -0.43 3.32 -1.05 -0.64 116.42 118.79 1xle h ASP 155 Ca 0.10 -0.16 -0.11 0.00 0.02 0.00 0.00 57.03 56.87 1xle h ASP 155 Cb 0.66 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 1xle h ASP 155 CO 0.05 0.73 -0.23 0.03 -1.72 0.00 0.00 179.24 178.09 1xle h ARG 156 N 0.79 0.70 -0.34 3.56 2.47 -0.98 -0.97 114.38 119.62 1xle h ARG 156 Ca 0.19 -0.28 -0.04 0.00 -1.26 0.00 0.00 59.98 58.59 1xle h ARG 156 Cb 0.18 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.45 1xle h ARG 156 CO -0.02 0.87 0.05 1.98 0.56 0.00 0.00 179.97 183.41 1xle h MET 157 N 0.61 0.57 -0.36 0.04 4.05 -0.71 -2.73 114.93 116.39 1xle h MET 157 Ca 0.09 -0.16 0.04 0.00 -0.28 0.00 0.00 59.70 59.39 1xle h MET 157 Cb 0.72 -0.06 -0.04 0.00 -0.80 0.00 0.00 31.60 31.42 1xle h MET 157 CO 0.06 0.65 0.15 -0.09 0.23 0.00 0.00 176.91 177.91 1xle h ARG 158 N 0.39 0.30 -0.21 0.39 2.43 -0.81 -2.15 114.38 114.72 1xle h ARG 158 Ca 0.10 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.29 1xle h ARG 158 Cb 0.37 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.81 1xle h ARG 158 CO 0.01 0.20 -0.02 1.49 -1.51 0.00 0.00 179.97 180.14 1xle h GLU 159 N 0.31 0.04 0.53 0.20 4.81 -1.14 0.13 114.58 119.45 1xle h GLU 159 Ca 0.16 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.37 1xle h GLU 159 Cb 0.12 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.49 1xle h GLU 159 CO -0.15 0.02 -0.29 0.78 -0.73 0.00 0.00 179.01 178.65 1xle h GLY 160 N 0.04 -0.80 1.03 1.92 0.00 -1.31 0.15 103.07 104.10 1xle h GLY 160 Ca 0.10 0.32 -0.03 0.00 0.00 0.00 0.00 47.33 47.72 1xle h GLY 160 CO -0.19 -0.29 0.34 -2.08 0.00 0.00 0.00 176.54 174.32 1xle h VAL 161 N -0.76 1.25 0.00 4.60 2.07 -1.10 -1.16 116.25 121.14 1xle h VAL 161 Ca -0.07 -0.73 -0.08 0.00 0.82 0.00 0.00 66.70 66.64 1xle h VAL 161 Cb 0.61 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1xle h VAL 161 CO 0.09 0.30 -0.36 0.44 0.02 0.00 0.00 177.57 178.06 1xle h ASP 162 N 1.08 0.00 0.03 0.57 3.32 -0.72 -1.53 116.42 119.17 1xle h ASP 162 Ca 0.26 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.31 1xle h ASP 162 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1xle h ASP 162 CO -0.03 0.36 -0.02 0.74 -1.72 0.00 0.00 179.24 178.58 1xle h THR 163 N 0.00 1.38 -0.74 0.35 2.02 -0.29 -2.11 112.91 113.52 1xle h THR 163 Ca -0.00 -1.44 0.08 0.00 0.77 0.00 0.00 66.41 65.81 1xle h THR 163 Cb 0.95 2.32 -0.06 0.00 -1.74 0.00 0.00 68.15 69.62 1xle h THR 163 CO 0.05 0.36 0.41 0.00 0.37 0.00 0.00 175.52 176.71 1xle h ALA 164 N 0.22 1.02 0.08 6.16 0.00 -1.06 -1.54 119.26 124.14 1xle h ALA 164 Ca -0.00 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1xle h ALA 164 Cb 0.62 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1xle h ALA 164 CO 0.01 0.06 -0.04 0.00 0.00 0.00 0.00 179.25 179.28 1xle h ALA 165 N 1.40 -0.10 -0.80 0.00 0.00 -1.37 -0.22 119.26 118.18 1xle h ALA 165 Ca 0.35 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.24 1xle h ALA 165 Cb 0.28 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 1xle h ALA 165 CO -0.22 -0.53 0.52 0.78 0.00 0.00 0.00 179.25 179.80 1xle h GLY 166 N -0.15 1.16 0.97 0.00 0.00 -1.13 0.12 103.07 104.03 1xle h GLY 166 Ca -0.01 -0.40 -0.00 0.00 0.00 0.00 0.00 47.33 46.92 1xle h GLY 166 CO 0.02 0.36 0.04 -1.82 0.00 0.00 0.00 176.54 175.14 1xle h TYR 167 N 1.03 0.09 -0.11 5.60 3.20 -0.92 0.24 116.97 126.10 1xle h TYR 167 Ca 0.31 0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.23 1xle h TYR 167 Cb -0.03 -0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.16 1xle h TYR 167 CO -0.02 0.09 -0.24 0.82 -1.64 0.00 0.00 178.16 177.17 1xle h ILE 168 N 0.06 0.43 -0.46 1.81 2.04 0.29 -1.00 117.51 120.68 1xle h ILE 168 Ca 0.03 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.93 1xle h ILE 168 Cb 0.03 0.43 -0.04 0.00 -0.74 0.00 0.00 36.82 36.49 1xle h ILE 168 CO -0.00 0.00 0.22 0.11 0.00 0.00 0.00 178.15 178.48 1xle h LYS 169 N -0.32 0.43 -0.78 2.37 1.57 -0.61 -1.14 116.57 118.10 1xle h LYS 169 Ca 0.09 -0.03 0.08 0.00 -1.87 0.00 0.00 60.65 58.93 1xle h LYS 169 Cb 0.45 -0.10 -0.07 0.00 0.08 0.00 0.00 32.23 32.60 1xle h LYS 169 CO -0.29 0.28 0.44 -0.44 -0.57 0.00 0.00 179.45 178.88 1xle h ASP 170 N 0.44 0.64 1.32 0.86 3.32 0.27 -2.41 116.42 120.86 1xle h ASP 170 Ca 0.20 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1xle h ASP 170 Cb 0.13 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1xle h ASP 170 CO -0.15 0.38 -0.20 0.11 -1.72 0.00 0.00 179.24 177.65 1xle h LYS 171 N 0.77 0.00 -5.02 3.56 1.79 -0.94 -3.48 116.57 113.25 1xle h LYS 171 Ca 0.37 0.00 -0.31 0.00 -2.18 0.00 0.00 60.65 58.52 1xle h LYS 171 Cb 0.30 0.00 0.12 0.00 -1.58 0.00 0.00 32.23 31.08 1xle h LYS 171 CO -0.23 0.00 -0.59 0.41 -1.08 0.00 0.00 179.45 177.97 1xle n GLY 172 N 1.30 -0.27 3.82 3.86 0.00 -0.47 -4.98 105.19 108.44 1xle n GLY 172 Ca 0.05 0.07 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1xle n GLY 172 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xle s TYR 173 N -3.28 3.22 -1.15 1.61 2.02 -0.93 -4.95 117.35 113.89 1xle s TYR 173 Ca 0.33 1.57 -0.07 0.00 -0.37 0.00 0.00 57.07 58.53 1xle s TYR 173 Cb -0.15 -2.92 0.26 0.00 -0.40 0.00 0.00 41.96 38.75 1xle s TYR 173 CO 0.60 -0.45 1.54 -1.71 -1.57 0.00 0.00 175.55 173.97 1xle n ASN 174 N -1.01 5.88 -3.97 2.29 5.15 -1.26 -4.77 115.26 117.56 1xle n ASN 174 Ca 0.08 -3.26 -0.15 0.00 -0.60 0.00 0.00 54.58 50.65 1xle n ASN 174 Cb 0.53 -1.36 -0.14 0.00 -0.53 0.00 0.00 39.78 38.29 1xle n ASN 174 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1xle s LEU 175 N -1.61 2.06 0.02 1.20 1.43 -1.26 -4.45 118.68 116.07 1xle s LEU 175 Ca 0.34 -0.18 0.08 0.00 -1.03 0.00 0.00 54.13 53.34 1xle s LEU 175 Cb 0.04 -0.24 -0.02 0.00 0.03 0.00 0.00 46.19 46.00 1xle s LEU 175 CO 0.05 0.01 -0.22 -0.13 0.23 0.00 0.00 176.35 176.28 1xle s ARG 176 N -0.41 1.63 -0.03 1.70 0.52 -0.68 -4.96 118.95 116.73 1xle s ARG 176 Ca -0.01 -0.92 -0.15 0.00 -0.52 0.00 0.00 55.73 54.14 1xle s ARG 176 Cb -0.04 -1.69 -0.05 0.00 0.52 0.00 0.00 34.95 33.69 1xle s ARG 176 CO -0.00 0.45 0.39 0.42 0.02 0.00 0.00 175.30 176.58 1xle s ILE 177 N -0.69 5.09 -0.12 1.52 1.01 -0.48 0.15 121.20 127.68 1xle s ILE 177 Ca 0.09 0.79 0.00 0.00 0.00 0.00 0.00 60.65 61.53 1xle s ILE 177 Cb -0.09 -3.70 0.02 0.00 0.01 0.00 0.00 42.46 38.71 1xle s ILE 177 CO 0.01 0.55 -0.10 0.00 0.00 0.00 0.00 174.94 175.39 1xle s ALA 178 N -0.84 1.49 0.16 9.38 0.00 -0.63 0.33 121.76 131.66 1xle s ALA 178 Ca 0.23 -0.64 -0.23 0.00 0.00 0.00 0.00 51.96 51.31 1xle s ALA 178 Cb -0.16 -0.92 -0.08 0.00 0.00 0.00 0.00 23.12 21.96 1xle s ALA 178 CO 0.12 -0.34 0.73 -0.51 0.00 0.00 0.00 175.76 175.76 1xle s LEU 179 N 1.52 4.53 -0.29 0.00 1.43 -0.66 -1.22 118.68 123.99 1xle s LEU 179 Ca 0.03 1.53 0.00 0.00 -1.03 0.00 0.00 54.13 54.66 1xle s LEU 179 Cb -0.13 -3.28 0.06 0.00 0.03 0.00 0.00 46.19 42.87 1xle s LEU 179 CO -0.08 0.19 -0.03 -0.70 0.23 0.00 0.00 176.35 175.96 1xle s GLU 180 N -1.31 2.29 0.43 1.70 2.12 -0.63 0.03 118.70 123.34 1xle s GLU 180 Ca 0.36 -1.35 -0.21 0.00 0.36 0.00 0.00 54.97 54.12 1xle s GLU 180 Cb -0.21 -3.09 -0.10 0.00 0.26 0.00 0.00 34.13 30.98 1xle s GLU 180 CO 0.24 -0.64 0.97 -2.14 -0.54 0.00 0.00 175.26 173.15 1xle s PRO 181 N 1.17 4.16 -0.25 4.30 0.02 -1.26 -4.23 135.00 138.92 1xle s PRO 181 Ca -0.05 1.19 -0.15 0.00 0.02 0.00 0.00 61.00 62.01 1xle s PRO 181 Cb -0.20 -2.20 0.07 0.00 0.02 0.00 0.00 34.50 32.19 1xle s PRO 181 CO -0.03 -0.10 0.62 0.21 -0.33 0.00 0.00 177.00 177.37 1xle s LYS 182 N -3.11 0.63 0.15 5.54 2.20 -1.22 -4.71 119.74 119.22 1xle s LYS 182 Ca 0.62 1.10 -0.06 0.00 -0.36 0.00 0.00 55.97 57.27 1xle s LYS 182 Cb -0.11 0.12 -0.01 0.00 -1.51 0.00 0.00 37.83 36.31 1xle s LYS 182 CO 0.15 -0.15 1.40 -1.00 -0.36 0.00 0.00 175.35 175.40 1xle h PRO 183 N 6.89 0.57 -3.03 4.03 0.13 -1.68 -3.37 132.00 135.55 1xle h PRO 183 Ca -0.32 -0.45 -0.01 0.00 -0.87 0.00 0.00 66.00 64.36 1xle h PRO 183 Cb 1.21 0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 1xle h PRO 183 CO 0.19 1.07 0.25 0.54 -0.23 0.00 0.00 178.00 179.82 1xle s ASN 184 N -7.01 -0.03 0.04 1.44 4.22 -1.26 -2.38 114.94 109.95 1xle s ASN 184 Ca -0.08 -1.05 0.00 0.00 -2.14 0.00 0.00 52.86 49.60 1xle s ASN 184 Cb 0.10 0.82 0.00 0.00 1.28 0.00 0.00 41.25 43.45 1xle s ASN 184 CO 0.86 -1.62 0.00 1.21 -2.04 0.00 0.00 177.10 175.52 1xle n GLU 185 N -0.52 -4.66 0.04 3.55 2.13 -1.26 -4.80 120.64 115.12 1xle n GLU 185 Ca -0.07 3.43 0.12 0.00 0.66 0.00 0.00 57.16 61.29 1xle n GLU 185 Cb 0.60 -4.20 0.49 0.00 0.27 0.00 0.00 31.44 28.60 1xle n GLU 185 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 1xle n PRO 186 N 1.63 0.08 -3.50 5.31 -0.04 -1.25 -5.01 135.00 132.21 1xle n PRO 186 Ca 0.00 0.15 -0.23 0.00 -0.04 0.00 0.00 63.50 63.38 1xle n PRO 186 Cb 0.00 -1.60 -0.01 0.00 -0.04 0.00 0.00 33.50 31.85 1xle n PRO 186 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1xle s ARG 187 N -3.06 3.41 0.08 0.54 1.81 -1.26 -5.01 118.95 115.47 1xle s ARG 187 Ca 0.11 -0.51 -0.22 0.00 -1.72 0.00 0.00 55.73 53.39 1xle s ARG 187 Cb 0.14 -2.72 -0.12 0.00 -0.45 0.00 0.00 34.95 31.80 1xle s ARG 187 CO 0.47 0.18 1.64 0.78 -0.68 0.00 0.00 175.30 177.69 1xle h GLY 188 N 0.84 0.17 -6.77 -3.53 0.00 -1.90 -3.41 103.07 88.47 1xle h GLY 188 Ca -0.50 -0.09 -0.49 0.00 0.00 0.00 0.00 47.33 46.26 1xle h GLY 188 CO 0.60 0.08 -0.79 0.99 0.00 0.00 0.00 176.54 177.43 1xle s ASP 189 N -5.45 1.91 -0.08 0.19 1.01 -0.80 -4.65 116.67 108.80 1xle s ASP 189 Ca -0.14 -0.21 -0.10 0.00 0.71 0.00 0.00 52.55 52.81 1xle s ASP 189 Cb 0.06 -0.68 -0.05 0.00 1.01 0.00 0.00 42.92 43.27 1xle s ASP 189 CO 0.69 -0.14 0.24 -0.63 0.21 0.00 0.00 175.17 175.53 1xle s ILE 190 N 1.76 5.33 0.47 0.77 1.01 -1.00 -1.59 121.20 127.95 1xle s ILE 190 Ca 0.04 0.45 -0.22 0.00 0.00 0.00 0.00 60.65 60.91 1xle s ILE 190 Cb -0.13 -3.52 -0.07 0.00 0.01 0.00 0.00 42.46 38.75 1xle s ILE 190 CO -0.07 0.60 1.16 -0.36 0.00 0.00 0.00 174.94 176.27 1xle s PHE 191 N -1.00 2.85 -1.09 3.97 0.08 -0.31 -3.41 117.98 119.06 1xle s PHE 191 Ca 0.18 1.54 -0.08 0.00 0.12 0.00 0.00 56.93 58.69 1xle s PHE 191 Cb -0.14 -3.36 -0.05 0.00 -0.57 0.00 0.00 43.02 38.90 1xle s PHE 191 CO 0.07 -1.51 0.90 1.28 -0.10 0.00 0.00 175.22 175.87 1xle n LEU 192 N -0.62 -4.94 0.25 -0.37 4.77 -1.26 -4.79 117.00 110.03 1xle n LEU 192 Ca 0.08 -0.76 0.13 0.00 -0.03 0.00 0.00 56.01 55.43 1xle n LEU 192 Cb 0.49 -3.05 0.62 0.00 -2.33 0.00 0.00 43.42 39.15 1xle n LEU 192 CO 0.47 0.20 0.91 1.55 -1.33 0.00 0.00 177.39 179.19 1xle h PRO 193 N -1.32 0.00 0.00 3.23 0.13 -1.71 -3.31 132.00 129.02 1xle h PRO 193 Ca -0.62 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.02 1xle h PRO 193 Cb 1.32 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.34 1xle h PRO 193 CO 0.46 0.13 -0.43 0.25 -0.23 0.00 0.00 178.00 178.17 1xle n THR 194 N -3.36 0.00 -0.12 1.56 -2.24 -1.26 -2.16 114.28 106.70 1xle n THR 194 Ca -0.00 -2.24 -0.09 0.00 -2.27 0.00 0.00 64.05 59.45 1xle n THR 194 Cb 0.33 0.93 -0.01 0.00 -2.10 0.00 0.00 70.33 69.48 1xle n THR 194 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1xle h VAL 195 N 1.77 1.14 -0.29 2.28 2.07 -1.94 -2.45 116.25 118.83 1xle h VAL 195 Ca -0.27 -0.35 0.06 0.00 0.82 0.00 0.00 66.70 66.96 1xle h VAL 195 Cb 1.13 0.70 -0.06 0.00 -1.52 0.00 0.00 31.29 31.54 1xle h VAL 195 CO 0.41 0.14 -0.09 1.23 0.02 0.00 0.00 177.57 179.29 1xle h GLY 196 N 0.48 0.19 1.00 2.17 0.00 -1.97 0.30 103.07 105.24 1xle h GLY 196 Ca 0.13 0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1xle h GLY 196 CO -0.02 -0.12 0.28 0.45 0.00 0.00 0.00 176.54 177.12 1xle h HIS 197 N -0.02 0.53 -0.01 5.60 -0.00 -1.91 0.20 115.15 119.54 1xle h HIS 197 Ca 0.14 0.01 0.03 0.00 -0.00 0.00 0.00 60.37 60.55 1xle h HIS 197 Cb 0.24 -0.18 -0.03 0.00 -0.00 0.00 0.00 27.41 27.44 1xle h HIS 197 CO -0.29 0.33 -0.16 0.78 -0.00 0.00 0.00 177.93 178.59 1xle h GLY 198 N 0.57 -0.20 0.99 2.45 0.00 -0.93 -1.34 103.07 104.60 1xle h GLY 198 Ca 0.15 0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.67 1xle h GLY 198 CO -0.03 -0.15 0.29 1.41 0.00 0.00 0.00 176.54 178.05 1xle h LEU 199 N -0.26 0.59 -0.05 3.11 3.38 0.04 -2.51 115.31 119.61 1xle h LEU 199 Ca 0.05 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1xle h LEU 199 Cb 0.33 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1xle h LEU 199 CO -0.16 0.48 0.01 0.00 0.09 0.00 0.00 178.44 178.86 1xle h ALA 200 N 1.14 0.06 -0.39 1.53 0.00 -0.38 -3.24 119.26 117.99 1xle h ALA 200 Ca 0.17 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.05 1xle h ALA 200 Cb -0.00 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 1xle h ALA 200 CO -0.03 -0.34 -0.03 0.35 0.00 0.00 0.00 179.25 179.20 1xle h PHE 201 N -0.12 -0.09 -0.96 0.00 3.57 -1.23 -2.59 116.94 115.53 1xle h PHE 201 Ca 0.01 0.03 0.23 0.00 3.53 0.00 0.00 57.97 61.77 1xle h PHE 201 Cb 0.21 0.10 -0.08 0.00 2.79 0.00 0.00 35.95 38.97 1xle h PHE 201 CO -0.01 -0.11 0.63 0.82 -2.23 0.00 0.00 178.31 177.41 1xle h ILE 202 N 0.07 0.63 0.00 1.41 2.04 -1.47 -1.80 117.51 118.38 1xle h ILE 202 Ca 0.19 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.91 1xle h ILE 202 Cb 0.28 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.54 1xle h ILE 202 CO -0.35 0.07 0.00 -0.62 0.00 0.00 0.00 178.15 177.26 1xle n GLU 203 N -4.54 0.05 -0.02 2.37 -0.58 -0.97 -2.69 120.64 114.25 1xle n GLU 203 Ca 0.21 0.27 0.07 0.00 -0.42 0.00 0.00 57.16 57.30 1xle n GLU 203 Cb 0.76 -1.50 0.07 0.00 -0.57 0.00 0.00 31.44 30.21 1xle n GLU 203 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1xle n GLN 204 N -1.43 1.20 -2.62 3.49 1.13 -0.68 -4.99 117.38 113.48 1xle n GLN 204 Ca 0.03 -1.45 -0.28 0.00 -1.94 0.00 0.00 57.00 53.36 1xle n GLN 204 Cb 0.12 -1.28 -0.01 0.00 0.11 0.00 0.00 30.24 29.17 1xle n GLN 204 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1xle s LEU 205 N -1.18 3.64 -0.11 1.08 1.43 -1.09 -5.00 118.68 117.44 1xle s LEU 205 Ca 0.18 1.02 -0.27 0.00 -1.03 0.00 0.00 54.13 54.03 1xle s LEU 205 Cb 0.12 -3.97 -0.26 0.00 0.03 0.00 0.00 46.19 42.12 1xle s LEU 205 CO 0.18 -0.56 0.85 -0.08 0.23 0.00 0.00 176.35 176.98 1xle h GLU 206 N 0.42 0.05 -1.06 1.70 4.81 -1.94 -3.35 114.58 115.22 1xle h GLU 206 Ca -0.47 -0.08 -0.51 0.00 -0.13 0.00 0.00 59.36 58.18 1xle h GLU 206 Cb 1.20 0.03 -0.26 0.00 0.63 0.00 0.00 28.75 30.35 1xle h GLU 206 CO 0.62 0.98 0.65 0.72 -0.73 0.00 0.00 179.01 181.25 1xle n HIS 207 N -4.56 2.70 0.02 0.92 8.25 -1.26 -4.74 115.22 116.54 1xle n HIS 207 Ca -0.10 -2.15 0.22 0.00 -0.26 0.00 0.00 57.72 55.43 1xle n HIS 207 Cb 0.50 -1.06 0.73 0.00 1.12 0.00 0.00 29.99 31.28 1xle n HIS 207 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1xle h GLY 208 N 1.75 0.00 0.67 -1.41 0.00 -1.77 -2.31 103.07 100.00 1xle h GLY 208 Ca 0.54 0.00 0.12 0.00 0.00 0.00 0.00 47.33 47.98 1xle h GLY 208 CO 1.14 0.00 0.56 1.29 0.00 0.00 0.00 176.54 179.53 1xle h ASP 209 N 0.00 0.70 -0.65 0.19 2.03 -1.90 -2.32 116.42 114.47 1xle h ASP 209 Ca 0.26 0.03 0.00 0.00 -0.73 0.00 0.00 57.03 56.59 1xle h ASP 209 Cb 1.23 -0.11 0.00 0.00 -0.83 0.00 0.00 39.33 39.61 1xle h ASP 209 CO -0.00 0.39 0.00 2.30 -1.03 0.00 0.00 179.24 180.90 1xle n ILE 210 N -4.54 1.31 -4.56 4.15 -5.35 -0.87 -4.94 119.36 104.57 1xle n ILE 210 Ca 0.16 -1.09 -0.33 0.00 -0.27 0.00 0.00 62.75 61.21 1xle n ILE 210 Cb 0.38 0.36 -0.14 0.00 -1.74 0.00 0.00 39.64 38.50 1xle n ILE 210 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1xle s VAL 211 N -1.32 3.37 0.00 7.28 1.01 -0.87 -1.38 120.40 128.48 1xle s VAL 211 Ca 0.47 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.91 1xle s VAL 211 Cb 0.27 -2.45 0.00 0.00 0.00 0.00 0.00 36.38 34.19 1xle s VAL 211 CO 0.28 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.49 1xle n GLY 212 N 3.65 4.90 3.58 4.51 0.00 0.15 -4.94 105.19 117.05 1xle n GLY 212 Ca -0.18 -1.35 -0.26 0.00 0.00 0.00 0.00 46.02 44.23 1xle n GLY 212 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xle s LEU 213 N 0.00 2.82 -0.41 0.99 1.43 0.56 -1.65 118.68 122.42 1xle s LEU 213 Ca 0.00 -1.20 0.08 0.00 -1.03 0.00 0.00 54.13 51.97 1xle s LEU 213 Cb 0.00 -1.05 0.24 0.00 0.03 0.00 0.00 46.19 45.41 1xle s LEU 213 CO 0.00 -0.28 0.52 -3.20 0.23 0.00 0.00 176.35 173.62 1xle n ASN 214 N -0.88 0.32 -4.75 2.29 5.15 0.10 -2.53 115.26 114.96 1xle n ASN 214 Ca -0.05 -2.71 -0.36 0.00 -0.60 0.00 0.00 54.58 50.86 1xle n ASN 214 Cb 0.64 -0.64 0.04 0.00 -0.53 0.00 0.00 39.78 39.30 1xle n ASN 214 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 1xle s PRO 215 N -1.16 2.87 -0.08 1.20 0.02 -1.26 -4.33 135.00 132.25 1xle s PRO 215 Ca 0.35 1.87 0.01 0.00 0.02 0.00 0.00 61.00 63.25 1xle s PRO 215 Cb 0.16 -1.91 0.02 0.00 0.02 0.00 0.00 34.50 32.79 1xle s PRO 215 CO -0.11 -1.30 -0.10 -2.00 -0.33 0.00 0.00 177.00 173.16 1xle s GLU 216 N -3.36 1.57 0.14 5.54 2.12 -1.26 -1.82 118.70 121.63 1xle s GLU 216 Ca 0.78 -0.33 -0.27 0.00 0.36 0.00 0.00 54.97 55.51 1xle s GLU 216 Cb -0.32 -1.42 -0.06 0.00 0.26 0.00 0.00 34.13 32.59 1xle s GLU 216 CO 0.35 -0.08 1.43 2.41 -0.54 0.00 0.00 175.26 178.82 1xle n THR 217 N 4.22 -0.59 -0.24 -1.70 -1.04 -0.97 -1.40 114.28 112.55 1xle n THR 217 Ca -0.20 2.23 0.07 0.00 -2.04 0.00 0.00 64.05 64.12 1xle n THR 217 Cb 0.51 -2.77 0.32 0.00 -1.82 0.00 0.00 70.33 66.57 1xle n THR 217 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1xle h GLY 218 N 0.00 1.13 0.81 3.41 0.00 -1.88 -2.47 103.07 104.08 1xle h GLY 218 Ca 0.14 -0.34 -0.04 0.00 0.00 0.00 0.00 47.33 47.09 1xle h GLY 218 CO -0.82 0.22 -0.04 0.45 0.00 0.00 0.00 176.54 176.34 1xle h HIS 219 N 0.82 0.45 -0.50 5.60 3.86 -1.56 -0.98 115.15 122.84 1xle h HIS 219 Ca 0.37 -0.09 -0.10 0.00 -1.16 0.00 0.00 60.37 59.38 1xle h HIS 219 Cb 0.35 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 28.69 1xle h HIS 219 CO -0.00 0.64 -0.11 0.93 0.86 0.00 0.00 177.93 180.25 1xle h GLU 220 N 0.13 0.92 0.00 2.45 4.39 -1.14 -2.13 114.58 119.20 1xle h GLU 220 Ca 0.05 -0.32 0.00 0.00 0.34 0.00 0.00 59.36 59.43 1xle h GLU 220 Cb 0.49 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 1xle h GLU 220 CO 0.02 0.98 0.00 1.96 -1.16 0.00 0.00 179.01 180.81 1xle h GLN 221 N 0.82 0.00 0.00 2.33 4.20 -1.36 -1.48 115.11 119.62 1xle h GLN 221 Ca 0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1xle h GLN 221 Cb 0.64 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.42 1xle h GLN 221 CO 0.04 0.00 0.00 -1.33 -0.67 0.00 0.00 178.83 176.87 1xle n MET 222 N -3.02 0.17 -0.12 1.46 2.81 -0.38 -2.28 117.12 115.74 1xle n MET 222 Ca -0.02 0.31 0.07 0.00 -1.81 0.00 0.00 57.70 56.25 1xle n MET 222 Cb 0.14 -1.77 0.14 0.00 -0.71 0.00 0.00 33.22 31.02 1xle n MET 222 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1xle n ALA 223 N -1.71 2.35 -1.01 3.04 0.00 -0.57 -4.80 120.51 117.80 1xle n ALA 223 Ca 0.04 -0.92 -0.00 0.00 0.00 0.00 0.00 53.44 52.55 1xle n ALA 223 Cb 0.28 -0.54 -0.00 0.00 0.00 0.00 0.00 19.45 19.19 1xle n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xle n GLY 224 N 0.83 0.45 3.89 0.00 0.00 -0.97 -5.02 105.19 104.37 1xle n GLY 224 Ca 0.12 -0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1xle n GLY 224 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xle s LEU 225 N -0.07 3.40 -0.42 0.99 1.43 -1.13 -4.98 118.68 117.91 1xle s LEU 225 Ca 0.00 1.16 -0.25 0.00 -1.03 0.00 0.00 54.13 54.01 1xle s LEU 225 Cb 0.00 -4.15 0.02 0.00 0.03 0.00 0.00 46.19 42.09 1xle s LEU 225 CO 0.00 -0.76 0.92 0.21 0.23 0.00 0.00 176.35 176.95 1xle s ASN 226 N -4.16 6.58 0.18 2.29 3.84 -1.26 -4.25 114.94 118.17 1xle s ASN 226 Ca 0.52 0.33 -0.11 0.00 0.21 0.00 0.00 52.86 53.81 1xle s ASN 226 Cb -0.11 -2.45 0.10 0.00 -0.55 0.00 0.00 41.25 38.24 1xle s ASN 226 CO 0.49 -0.95 1.74 0.15 -2.79 0.00 0.00 177.10 175.74 1xle h PHE 227 N 8.79 1.01 -0.68 0.43 3.57 -1.93 -1.60 116.94 126.53 1xle h PHE 227 Ca -0.24 -0.08 -0.03 0.00 3.53 0.00 0.00 57.97 61.16 1xle h PHE 227 Cb 1.08 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 39.49 1xle h PHE 227 CO 0.85 0.80 0.32 1.15 -2.23 0.00 0.00 178.31 179.20 1xle h THR 228 N 0.93 1.23 0.05 4.41 2.02 -1.92 -0.39 112.91 119.24 1xle h THR 228 Ca 0.22 -0.65 0.02 0.00 0.77 0.00 0.00 66.41 66.77 1xle h THR 228 Cb 0.22 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 67.00 1xle h THR 228 CO -0.02 0.27 -0.24 0.45 0.37 0.00 0.00 175.52 176.35 1xle h HIS 229 N 0.95 -0.64 0.16 3.16 3.86 -1.86 0.14 115.15 120.91 1xle h HIS 229 Ca 0.23 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.45 1xle h HIS 229 Cb 0.13 0.28 0.00 0.00 1.06 0.00 0.00 27.41 28.87 1xle h HIS 229 CO 0.01 -0.33 -0.07 0.78 0.86 0.00 0.00 177.93 179.17 1xle h GLY 230 N -0.41 -0.22 1.61 2.45 0.00 -1.05 -2.37 103.07 103.09 1xle h GLY 230 Ca 0.05 0.08 -0.05 0.00 0.00 0.00 0.00 47.33 47.41 1xle h GLY 230 CO -0.18 -0.08 -0.03 0.16 0.00 0.00 0.00 176.54 176.41 1xle h ILE 231 N -0.30 1.20 -0.21 2.60 3.07 -1.03 -1.77 117.51 121.06 1xle h ILE 231 Ca -0.02 -0.81 0.06 0.00 1.55 0.00 0.00 64.86 65.64 1xle h ILE 231 Cb 0.24 1.00 -0.07 0.00 -0.27 0.00 0.00 36.82 37.72 1xle h ILE 231 CO 0.04 0.27 -0.26 0.00 -1.05 0.00 0.00 178.15 177.14 1xle h ALA 232 N 1.51 -0.20 -0.76 0.16 0.00 -0.59 0.27 119.26 119.66 1xle h ALA 232 Ca 0.10 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1xle h ALA 232 Cb 0.35 0.54 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 1xle h ALA 232 CO 0.01 -0.70 0.37 0.37 0.00 0.00 0.00 179.25 179.30 1xle h GLN 233 N -0.29 1.08 0.04 0.00 4.15 -0.85 0.66 115.11 119.90 1xle h GLN 233 Ca 0.13 -0.15 -0.00 0.00 0.77 0.00 0.00 58.65 59.40 1xle h GLN 233 Cb 0.48 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 27.97 1xle h GLN 233 CO -0.38 0.83 -0.02 0.00 -1.93 0.00 0.00 178.83 177.33 1xle h ALA 234 N 1.33 -0.05 -0.27 3.38 0.00 -0.71 -0.73 119.26 122.21 1xle h ALA 234 Ca 0.26 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1xle h ALA 234 Cb 0.10 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1xle h ALA 234 CO -0.03 -0.44 0.18 1.25 0.00 0.00 0.00 179.25 180.20 1xle h LEU 235 N -0.24 0.30 -0.83 0.00 6.46 -0.65 -0.70 115.31 119.65 1xle h LEU 235 Ca -0.01 -0.01 0.08 0.00 -0.12 0.00 0.00 57.88 57.83 1xle h LEU 235 Cb 0.21 -0.07 -0.07 0.00 -0.73 0.00 0.00 40.66 40.00 1xle h LEU 235 CO 0.01 0.22 0.49 -0.25 -0.62 0.00 0.00 178.44 178.29 1xle h TRP 236 N 0.36 0.90 0.00 1.25 7.01 -0.84 0.17 115.95 124.80 1xle h TRP 236 Ca 0.10 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.13 1xle h TRP 236 Cb -0.03 -0.28 0.00 0.00 -2.10 0.00 0.00 29.16 26.74 1xle h TRP 236 CO -0.06 0.41 0.00 0.00 -2.79 0.00 0.00 178.44 175.99 1xle n ALA 237 N -2.37 2.40 -3.39 2.65 0.00 -0.28 -4.91 120.51 114.60 1xle n ALA 237 Ca 0.13 -0.14 -0.18 0.00 0.00 0.00 0.00 53.44 53.25 1xle n ALA 237 Cb 0.24 -1.44 0.08 0.00 0.00 0.00 0.00 19.45 18.33 1xle n ALA 237 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1xle n GLU 238 N -1.18 -6.55 -0.02 0.00 2.13 0.59 -4.92 120.64 110.69 1xle n GLU 238 Ca 0.16 0.80 0.00 0.00 0.66 0.00 0.00 57.16 58.78 1xle n GLU 238 Cb 0.17 -5.69 0.01 0.00 0.27 0.00 0.00 31.44 26.19 1xle n GLU 238 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1xle n LYS 239 N -4.14 1.49 -2.97 5.31 4.76 -0.37 -4.94 118.16 117.31 1xle n LYS 239 Ca -0.21 -1.07 -0.44 0.00 -2.87 0.00 0.00 58.31 53.71 1xle n LYS 239 Cb 0.64 -0.78 -0.02 0.00 -1.84 0.00 0.00 35.03 33.03 1xle n LYS 239 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1xle s LEU 240 N -0.59 5.20 0.09 -0.35 2.96 -1.23 -0.33 118.68 124.45 1xle s LEU 240 Ca 0.01 -2.43 0.15 0.00 -0.22 0.00 0.00 54.13 51.64 1xle s LEU 240 Cb 0.01 -2.38 -0.12 0.00 0.50 0.00 0.00 46.19 44.19 1xle s LEU 240 CO 0.00 -0.91 0.96 -0.26 -1.32 0.00 0.00 176.35 174.82 1xle h PHE 241 N 8.18 0.00 -3.25 5.38 -1.00 -1.86 -3.48 116.94 120.92 1xle h PHE 241 Ca 0.20 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.98 1xle h PHE 241 Cb 0.97 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.48 1xle h PHE 241 CO 1.13 0.69 0.12 -1.58 -1.61 0.00 0.00 178.31 177.05 1xle s HIS 242 N -2.85 0.10 -0.02 -0.55 2.46 -1.05 -4.88 115.29 108.50 1xle s HIS 242 Ca -0.02 -0.55 -0.14 0.00 0.47 0.00 0.00 55.06 54.83 1xle s HIS 242 Cb 0.08 0.54 0.02 0.00 -0.13 0.00 0.00 32.58 33.10 1xle s HIS 242 CO 0.80 -1.23 0.29 -1.50 -2.47 0.00 0.00 174.74 170.64 1xle s ILE 243 N -3.61 0.06 -0.19 0.89 2.07 -1.26 -4.14 121.20 115.02 1xle s ILE 243 Ca 0.16 -0.46 -0.00 0.00 -1.41 0.00 0.00 60.65 58.94 1xle s ILE 243 Cb -0.04 -0.58 0.01 0.00 0.13 0.00 0.00 42.46 41.99 1xle s ILE 243 CO 0.09 -0.25 -0.16 -1.81 -1.91 0.00 0.00 174.94 170.90 1xle s ASP 244 N -1.20 3.42 -0.14 4.50 1.11 -0.76 -3.50 116.67 120.11 1xle s ASP 244 Ca -0.12 -0.58 -0.04 0.00 0.18 0.00 0.00 52.55 51.98 1xle s ASP 244 Cb -0.05 -1.54 -0.03 0.00 1.07 0.00 0.00 42.92 42.36 1xle s ASP 244 CO 0.04 0.00 0.01 -0.76 1.18 0.00 0.00 175.17 175.64 1xle s LEU 245 N 1.29 3.54 0.00 1.23 1.43 -0.16 -2.29 118.68 123.73 1xle s LEU 245 Ca 0.04 0.03 -0.03 0.00 -1.03 0.00 0.00 54.13 53.14 1xle s LEU 245 Cb -0.13 -1.85 0.01 0.00 0.03 0.00 0.00 46.19 44.25 1xle s LEU 245 CO -0.10 0.25 0.16 -0.46 0.23 0.00 0.00 176.35 176.43 1xle n ASN 246 N 3.03 -0.28 -4.19 2.29 0.23 -1.26 -2.60 115.26 112.48 1xle n ASN 246 Ca -0.18 -1.15 -0.23 0.00 -0.53 0.00 0.00 54.58 52.50 1xle n ASN 246 Cb 0.53 0.45 -0.14 0.00 -2.08 0.00 0.00 39.78 38.54 1xle n ASN 246 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1xle s GLY 247 N -2.08 0.93 -0.05 4.83 0.00 -0.77 -4.43 107.32 105.75 1xle s GLY 247 Ca 0.04 -0.90 -0.02 0.00 0.00 0.00 0.00 44.72 43.84 1xle s GLY 247 CO 0.01 -0.84 0.10 1.62 0.00 0.00 0.00 173.10 174.00 1xle s GLN 248 N -1.01 0.02 -0.90 2.90 2.00 -1.26 -1.09 119.66 120.31 1xle s GLN 248 Ca 0.05 0.36 -0.10 0.00 -2.00 0.00 0.00 55.36 53.67 1xle s GLN 248 Cb -0.08 -0.27 0.23 0.00 0.80 0.00 0.00 33.01 33.69 1xle s GLN 248 CO 0.01 -0.22 0.85 1.03 -0.50 0.00 0.00 175.29 176.46 1xle s ARG 249 N 1.53 3.67 0.00 1.67 0.52 -1.26 -3.63 118.95 121.45 1xle s ARG 249 Ca -0.04 -2.78 0.00 0.00 -0.52 0.00 0.00 55.73 52.38 1xle s ARG 249 Cb -0.12 -4.36 0.00 0.00 0.52 0.00 0.00 34.95 30.99 1xle s ARG 249 CO -0.05 -1.26 0.00 0.41 0.02 0.00 0.00 175.30 174.42 1xle n GLY 250 N 3.38 -0.19 3.51 -3.53 0.00 -1.26 -4.83 105.19 102.27 1xle n GLY 250 Ca 0.17 -1.86 -0.43 0.00 0.00 0.00 0.00 46.02 43.91 1xle n GLY 250 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xle s ILE 251 N -1.31 4.35 0.00 -0.61 1.01 -1.26 -4.66 121.20 118.73 1xle s ILE 251 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 60.65 60.86 1xle s ILE 251 Cb 0.00 -4.57 0.00 0.00 0.01 0.00 0.00 42.46 37.90 1xle s ILE 251 CO 0.00 -1.19 0.00 2.29 0.00 0.00 0.00 174.94 176.04 1xle n LYS 252 N 7.57 0.00 -1.14 2.79 2.85 -1.26 -5.10 118.16 123.87 1xle n LYS 252 Ca 0.01 0.00 -0.33 0.00 -1.05 0.00 0.00 58.31 56.94 1xle n LYS 252 Cb 0.47 0.00 0.12 0.00 -0.65 0.00 0.00 35.03 34.97 1xle n LYS 252 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 177.40 178.87 1xle s TYR 253 N -3.79 1.94 -0.29 5.58 1.13 -1.26 -4.85 117.35 115.81 1xle s TYR 253 Ca 0.00 1.67 -0.28 0.00 -1.41 0.00 0.00 57.07 57.05 1xle s TYR 253 Cb 0.00 -3.38 -0.04 0.00 -1.10 0.00 0.00 41.96 37.43 1xle s TYR 253 CO 0.00 -2.61 2.11 0.34 -2.51 0.00 0.00 175.55 172.88 1xle s ASP 254 N -2.41 5.46 0.09 -0.18 2.15 -1.26 -4.84 116.67 115.69 1xle s ASP 254 Ca 0.70 1.60 -0.03 0.00 0.43 0.00 0.00 52.55 55.24 1xle s ASP 254 Cb -0.26 -2.51 -0.22 0.00 -0.30 0.00 0.00 42.92 39.63 1xle s ASP 254 CO 0.51 -2.00 1.20 1.56 -0.17 0.00 0.00 175.17 176.27 1xle h GLN 255 N 14.94 0.28 -6.02 4.34 4.20 -1.89 -3.49 115.11 127.49 1xle h GLN 255 Ca -0.37 -0.43 -0.41 0.00 0.06 0.00 0.00 58.65 57.51 1xle h GLN 255 Cb 1.22 0.15 0.07 0.00 0.30 0.00 0.00 27.48 29.22 1xle h GLN 255 CO 1.01 1.17 -0.82 -0.25 -0.67 0.00 0.00 178.83 179.27 1xle n ASP 256 N -3.58 -1.49 -4.17 1.46 8.00 -1.21 -4.76 116.55 110.79 1xle n ASP 256 Ca -0.07 -0.78 -0.30 0.00 0.71 0.00 0.00 54.79 54.35 1xle n ASP 256 Cb 0.97 -4.24 0.18 0.00 -0.02 0.00 0.00 41.12 38.00 1xle n ASP 256 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xle s LEU 257 N -6.65 2.52 0.61 0.64 1.43 -0.25 -0.40 118.68 116.58 1xle s LEU 257 Ca 0.03 0.35 -0.18 0.00 -1.03 0.00 0.00 54.13 53.30 1xle s LEU 257 Cb -0.02 -2.40 -0.03 0.00 0.03 0.00 0.00 46.19 43.78 1xle s LEU 257 CO 0.80 -2.79 1.24 -0.69 0.23 0.00 0.00 176.35 175.14 1xle s VAL 258 N -3.78 2.43 0.17 -1.59 1.01 -1.26 -1.84 120.40 115.53 1xle s VAL 258 Ca 0.73 0.27 -0.32 0.00 0.00 0.00 0.00 61.98 62.66 1xle s VAL 258 Cb -0.05 -3.10 -0.11 0.00 0.00 0.00 0.00 36.38 33.12 1xle s VAL 258 CO 0.53 -0.06 1.73 0.12 0.00 0.00 0.00 175.10 177.42 1xle s PHE 259 N -1.54 2.67 0.00 5.22 5.36 -1.26 -1.78 117.98 126.65 1xle s PHE 259 Ca 0.79 0.28 0.00 0.00 -0.96 0.00 0.00 56.93 57.04 1xle s PHE 259 Cb -0.33 -4.11 0.00 0.00 -0.34 0.00 0.00 43.02 38.25 1xle s PHE 259 CO 0.35 -4.31 0.00 0.41 -1.46 0.00 0.00 175.22 170.22 1xle n GLY 260 N 4.02 0.88 0.78 13.12 0.00 -1.26 -4.78 105.19 117.95 1xle n GLY 260 Ca 0.16 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 1xle n GLY 260 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1xle n HIS 261 N -2.00 0.10 0.00 1.61 8.25 -0.74 -4.50 115.22 117.94 1xle n HIS 261 Ca 0.00 -0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.41 1xle n HIS 261 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1xle n HIS 261 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xle n GLY 262 N 1.29 0.75 3.55 -1.41 0.00 -1.26 -4.82 105.19 103.29 1xle n GLY 262 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1xle n GLY 262 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xle s ASP 263 N -0.66 5.99 0.12 1.61 -1.08 -1.24 -4.88 116.67 116.53 1xle s ASP 263 Ca 0.00 -0.57 -0.18 0.00 -0.52 0.00 0.00 52.55 51.29 1xle s ASP 263 Cb 0.00 -2.56 -0.03 0.00 -1.46 0.00 0.00 42.92 38.87 1xle s ASP 263 CO 0.00 -1.94 1.71 0.25 0.52 0.00 0.00 175.17 175.71 1xle h LEU 264 N 14.03 0.40 -0.95 -1.34 5.85 -1.93 -1.27 115.31 130.10 1xle h LEU 264 Ca -0.13 -0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.50 1xle h LEU 264 Cb 1.06 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.94 1xle h LEU 264 CO 1.30 0.40 0.63 0.74 -0.34 0.00 0.00 178.44 181.16 1xle h THR 265 N 0.38 1.24 -0.21 1.05 2.02 -1.96 -0.44 112.91 115.00 1xle h THR 265 Ca 0.11 -0.44 -0.08 0.00 0.77 0.00 0.00 66.41 66.77 1xle h THR 265 Cb 0.09 -0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.33 1xle h THR 265 CO -0.02 0.23 -0.21 -1.28 0.37 0.00 0.00 175.52 174.62 1xle h SER 266 N 1.28 0.36 -0.50 4.18 0.87 -1.91 -2.23 113.55 115.60 1xle h SER 266 Ca 0.35 -0.10 -0.12 0.00 -1.23 0.00 0.00 61.79 60.69 1xle h SER 266 Cb -0.13 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 61.71 1xle h SER 266 CO -0.08 0.58 -0.14 0.00 -0.53 0.00 0.00 176.83 176.66 1xle h ALA 267 N 1.45 0.77 0.13 6.23 0.00 -0.55 0.39 119.26 127.68 1xle h ALA 267 Ca 0.06 -0.36 0.02 0.00 0.00 0.00 0.00 54.91 54.62 1xle h ALA 267 Cb 0.56 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1xle h ALA 267 CO 0.04 0.67 -0.31 0.35 0.00 0.00 0.00 179.25 180.00 1xle h PHE 268 N 0.87 -0.83 0.00 0.00 3.57 -0.50 0.12 116.94 120.18 1xle h PHE 268 Ca 0.13 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.57 1xle h PHE 268 Cb 0.71 0.35 -0.01 0.00 2.79 0.00 0.00 35.95 39.78 1xle h PHE 268 CO 0.05 -0.41 -0.35 0.74 -2.23 0.00 0.00 178.31 176.10 1xle h PHE 269 N -0.53 0.00 0.20 0.41 0.04 -1.44 -1.06 116.94 114.56 1xle h PHE 269 Ca 0.03 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.79 1xle h PHE 269 Cb 0.56 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.71 1xle h PHE 269 CO -0.27 0.35 -0.10 1.15 -0.60 0.00 0.00 178.31 178.85 1xle h THR 270 N 0.00 0.88 -0.97 -1.55 2.02 0.31 -1.44 112.91 112.16 1xle h THR 270 Ca -0.00 -0.50 0.06 0.00 0.77 0.00 0.00 66.41 66.73 1xle h THR 270 Cb 0.70 1.17 -0.06 0.00 -1.74 0.00 0.00 68.15 68.22 1xle h THR 270 CO 0.05 0.11 0.62 0.58 0.37 0.00 0.00 175.52 177.25 1xle h VAL 271 N -0.53 1.09 -0.19 3.16 2.07 -0.50 -0.25 116.25 121.11 1xle h VAL 271 Ca -0.03 -0.39 0.01 0.00 0.82 0.00 0.00 66.70 67.11 1xle h VAL 271 Cb 0.40 -0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.00 1xle h VAL 271 CO 0.05 0.21 0.09 -0.78 0.02 0.00 0.00 177.57 177.16 1xle h ASP 272 N 1.14 0.14 -0.51 0.57 3.58 -1.08 -0.11 116.42 120.15 1xle h ASP 272 Ca 0.41 0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.85 1xle h ASP 272 Cb 0.14 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.15 1xle h ASP 272 CO -0.16 0.11 0.25 0.25 -2.88 0.00 0.00 179.24 176.80 1xle h LEU 273 N 0.20 0.67 -0.39 2.28 5.85 -0.72 0.52 115.31 123.71 1xle h LEU 273 Ca 0.08 -0.13 -0.12 0.00 0.84 0.00 0.00 57.88 58.55 1xle h LEU 273 Cb 0.02 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 1xle h LEU 273 CO -0.05 0.61 -0.23 -0.07 -0.34 0.00 0.00 178.44 178.35 1xle h LEU 274 N 0.68 0.89 0.03 2.25 3.38 -0.52 -0.25 115.31 121.77 1xle h LEU 274 Ca 0.18 -0.42 -0.06 0.00 0.09 0.00 0.00 57.88 57.67 1xle h LEU 274 Cb 0.11 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.62 1xle h LEU 274 CO -0.02 1.11 -0.28 -0.33 0.09 0.00 0.00 178.44 179.01 1xle h GLU 275 N 0.66 0.07 0.00 1.13 4.39 -0.99 -3.40 114.58 116.45 1xle h GLU 275 Ca 0.08 -0.12 -0.16 0.00 0.34 0.00 0.00 59.36 59.50 1xle h GLU 275 Cb 0.80 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.47 1xle h GLU 275 CO 0.07 1.06 -1.54 0.09 -1.16 0.00 0.00 179.01 177.53 1xle n ASN 276 N -4.48 0.70 0.00 1.42 3.02 0.18 -5.06 115.26 111.03 1xle n ASN 276 Ca -0.12 0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.73 1xle n ASN 276 Cb 0.58 0.42 0.00 0.00 -0.61 0.00 0.00 39.78 40.17 1xle n ASN 276 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xle n GLY 277 N 1.41 -0.04 3.78 7.41 0.00 -0.11 -4.83 105.19 112.81 1xle n GLY 277 Ca -0.11 -1.01 -0.36 0.00 0.00 0.00 0.00 46.02 44.54 1xle n GLY 277 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xle s PHE 278 N 0.00 3.40 0.29 1.61 0.08 -1.26 -4.51 117.98 117.59 1xle s PHE 278 Ca 0.00 0.36 -0.03 0.00 0.12 0.00 0.00 56.93 57.38 1xle s PHE 278 Cb 0.00 -1.91 0.58 0.00 -0.57 0.00 0.00 43.02 41.13 1xle s PHE 278 CO 0.00 0.57 1.52 -2.30 -0.10 0.00 0.00 175.22 174.91 1xle n PRO 279 N 2.24 -0.08 -0.17 0.24 -0.02 -1.26 0.11 135.00 136.05 1xle n PRO 279 Ca -0.19 1.49 0.07 0.00 -2.02 0.00 0.00 63.50 62.84 1xle n PRO 279 Cb 0.54 -2.29 0.20 0.00 -0.02 0.00 0.00 33.50 31.93 1xle n PRO 279 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1xle n ASN 280 N -5.52 1.94 0.00 2.55 3.02 -1.26 -5.03 115.26 110.95 1xle n ASN 280 Ca 0.19 -1.95 0.00 0.00 -0.03 0.00 0.00 54.58 52.79 1xle n ASN 280 Cb 0.61 -0.23 0.00 0.00 -0.61 0.00 0.00 39.78 39.55 1xle n ASN 280 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xle n GLY 281 N 1.10 0.20 0.00 7.41 0.00 0.30 -5.10 105.19 109.10 1xle n GLY 281 Ca 0.13 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.49 1xle n GLY 281 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xle n GLY 282 N 0.43 0.54 3.80 -0.02 0.00 -1.26 -4.75 105.19 103.92 1xle n GLY 282 Ca 0.00 -1.50 -0.31 0.00 0.00 0.00 0.00 46.02 44.21 1xle n GLY 282 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xle s PRO 283 N -2.00 2.66 0.10 1.61 0.04 -1.26 -4.88 135.00 131.27 1xle s PRO 283 Ca 0.00 1.04 0.04 0.00 0.04 0.00 0.00 61.00 62.11 1xle s PRO 283 Cb 0.00 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 1xle s PRO 283 CO 0.00 -1.32 -0.10 0.15 0.04 0.00 0.00 177.00 175.77 1xle s LYS 284 N -4.99 0.84 -0.24 4.56 -0.14 -1.26 -4.39 119.74 114.11 1xle s LYS 284 Ca 0.59 -1.16 -0.08 0.00 -1.36 0.00 0.00 55.97 53.96 1xle s LYS 284 Cb -0.15 -0.52 -0.03 0.00 -1.68 0.00 0.00 37.83 35.44 1xle s LYS 284 CO 0.55 0.08 0.09 -0.47 -0.76 0.00 0.00 175.35 174.84 1xle s TYR 285 N -2.47 3.13 -0.20 3.18 5.04 -1.26 -4.98 117.35 119.79 1xle s TYR 285 Ca 0.05 -0.26 0.15 0.00 -2.44 0.00 0.00 57.07 54.57 1xle s TYR 285 Cb -0.03 -2.24 0.46 0.00 0.35 0.00 0.00 41.96 40.50 1xle s TYR 285 CO -0.00 -0.25 1.36 -2.37 -1.34 0.00 0.00 175.55 172.94 1xle n THR 286 N 4.75 2.26 -2.21 4.34 5.66 -1.26 -4.92 114.28 122.90 1xle n THR 286 Ca -0.16 -2.31 0.00 0.00 -3.05 0.00 0.00 64.05 58.53 1xle n THR 286 Cb 0.52 -0.27 0.00 0.00 -1.55 0.00 0.00 70.33 69.03 1xle n THR 286 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1xle n GLY 287 N -0.94 0.98 3.77 1.09 0.00 -1.26 -5.07 105.19 103.76 1xle n GLY 287 Ca 0.23 -1.97 -0.34 0.00 0.00 0.00 0.00 46.02 43.94 1xle n GLY 287 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xle s PRO 288 N -1.61 3.00 -0.58 1.61 0.04 -1.26 -4.98 135.00 131.21 1xle s PRO 288 Ca 0.00 1.44 -0.11 0.00 0.04 0.00 0.00 61.00 62.37 1xle s PRO 288 Cb 0.00 -1.97 0.15 0.00 0.04 0.00 0.00 34.50 32.72 1xle s PRO 288 CO 0.00 -1.10 0.48 1.03 0.04 0.00 0.00 177.00 177.45 1xle s ARG 289 N -3.86 2.84 -0.13 4.56 3.00 0.91 -4.42 118.95 121.85 1xle s ARG 289 Ca 0.68 -1.99 -0.09 0.00 0.00 0.00 0.00 55.73 54.33 1xle s ARG 289 Cb -0.21 -4.10 -0.04 0.00 0.00 0.00 0.00 34.95 30.60 1xle s ARG 289 CO 0.37 -1.25 0.18 -1.58 0.00 0.00 0.00 175.30 173.02 1xle s HIS 290 N 1.00 3.56 -0.24 -0.53 2.46 -1.23 -2.35 115.29 117.96 1xle s HIS 290 Ca 0.09 0.54 -0.04 0.00 0.47 0.00 0.00 55.06 56.12 1xle s HIS 290 Cb -0.23 -2.05 -0.00 0.00 -0.13 0.00 0.00 32.58 30.17 1xle s HIS 290 CO -0.02 0.60 -0.01 -0.06 -2.47 0.00 0.00 174.74 172.78 1xle s PHE 291 N -0.64 3.02 -0.70 3.88 0.08 -0.96 -0.99 117.98 121.67 1xle s PHE 291 Ca 0.15 -1.01 -0.00 0.00 0.12 0.00 0.00 56.93 56.19 1xle s PHE 291 Cb -0.12 -2.14 0.18 0.00 -0.57 0.00 0.00 43.02 40.36 1xle s PHE 291 CO 0.04 -0.57 0.52 0.34 -0.10 0.00 0.00 175.22 175.45 1xle s ASP 292 N 1.47 5.25 0.37 1.36 2.15 -1.07 -3.61 116.67 122.59 1xle s ASP 292 Ca 0.04 -3.32 0.04 0.00 0.43 0.00 0.00 52.55 49.74 1xle s ASP 292 Cb -0.15 -1.80 -0.03 0.00 -0.30 0.00 0.00 42.92 40.63 1xle s ASP 292 CO -0.02 -0.24 0.14 -0.72 -0.17 0.00 0.00 175.17 174.16 1xle s TYR 293 N -0.74 1.75 -0.09 -5.34 1.13 -1.26 -4.61 117.35 108.20 1xle s TYR 293 Ca 0.21 -1.31 -0.03 0.00 -1.41 0.00 0.00 57.07 54.53 1xle s TYR 293 Cb -0.14 -1.06 0.05 0.00 -1.10 0.00 0.00 41.96 39.71 1xle s TYR 293 CO -0.08 -0.37 0.17 0.15 -2.51 0.00 0.00 175.55 172.91 1xle s LYS 294 N -3.73 0.05 0.11 -3.49 1.02 0.46 -4.34 119.74 109.82 1xle s LYS 294 Ca 0.29 0.56 -0.31 0.00 0.02 0.00 0.00 55.97 56.54 1xle s LYS 294 Cb 0.04 -0.24 -0.09 0.00 -0.52 0.00 0.00 37.83 37.01 1xle s LYS 294 CO 0.16 -0.29 1.71 -2.14 -0.92 0.00 0.00 175.35 173.88 1xle s PRO 295 N 2.19 4.17 0.25 -1.68 0.02 -1.26 -4.67 135.00 134.02 1xle s PRO 295 Ca 0.02 2.44 -0.29 0.00 0.02 0.00 0.00 61.00 63.19 1xle s PRO 295 Cb -0.12 -3.53 -0.15 0.00 0.02 0.00 0.00 34.50 30.72 1xle s PRO 295 CO -0.06 -0.76 0.93 0.43 -0.33 0.00 0.00 177.00 177.20 1xle n SER 296 N 5.38 0.74 0.17 2.53 7.64 -1.26 -4.86 113.62 123.97 1xle n SER 296 Ca 0.16 1.16 0.13 0.00 1.01 0.00 0.00 58.87 61.34 1xle n SER 296 Cb 0.39 -1.20 0.54 0.00 -1.01 0.00 0.00 64.21 62.94 1xle n SER 296 CO 0.00 0.00 0.00 0.08 -3.01 0.00 0.00 175.04 172.11 1xle h ARG 297 N 1.99 0.00 0.00 1.43 0.11 -1.92 -2.59 114.38 113.40 1xle h ARG 297 Ca -0.38 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.70 1xle h ARG 297 Cb 1.36 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.44 1xle h ARG 297 CO 0.61 0.00 0.00 1.79 0.10 0.00 0.00 179.97 182.47 1xle h THR 298 N 0.00 0.00 -3.17 0.08 1.35 -1.98 -3.45 112.91 105.74 1xle h THR 298 Ca 0.00 -0.61 -0.66 0.00 -0.55 0.00 0.00 66.41 64.59 1xle h THR 298 Cb 0.42 1.58 -0.11 0.00 -1.73 0.00 0.00 68.15 68.30 1xle h THR 298 CO 0.00 0.00 -0.59 -1.81 -0.25 0.00 0.00 175.52 172.87 1xle s ASP 299 N -5.56 5.54 0.40 5.36 1.11 -0.98 -5.12 116.67 117.42 1xle s ASP 299 Ca 0.04 0.11 0.00 0.00 0.18 0.00 0.00 52.55 52.88 1xle s ASP 299 Cb 0.08 -1.56 0.00 0.00 1.07 0.00 0.00 42.92 42.51 1xle s ASP 299 CO 0.56 0.28 0.00 0.61 1.18 0.00 0.00 175.17 177.80 1xle n GLY 300 N 1.27 -0.82 0.28 0.21 0.00 -1.26 -4.81 105.19 100.06 1xle n GLY 300 Ca -0.14 -1.66 0.14 0.00 0.00 0.00 0.00 46.02 44.36 1xle n GLY 300 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1xle h TYR 301 N -0.40 0.00 -0.04 1.61 0.05 -1.99 -1.88 116.97 114.32 1xle h TYR 301 Ca 0.00 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.68 1xle h TYR 301 Cb 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.73 1xle h TYR 301 CO 0.00 0.08 -0.43 -0.44 -1.05 0.00 0.00 178.16 176.32 1xle h ASP 302 N 0.00 0.09 0.57 3.88 3.32 -2.00 -1.91 116.42 120.36 1xle h ASP 302 Ca -0.00 -0.04 -0.22 0.00 0.02 0.00 0.00 57.03 56.79 1xle h ASP 302 Cb 0.22 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 1xle h ASP 302 CO 0.01 0.51 -0.98 1.23 -1.72 0.00 0.00 179.24 178.30 1xle h GLY 303 N 1.29 0.28 0.51 2.75 0.00 -1.70 -2.67 103.07 103.53 1xle h GLY 303 Ca 0.00 -0.54 -0.02 0.00 0.00 0.00 0.00 47.33 46.78 1xle h GLY 303 CO 0.06 0.48 -0.46 -2.08 0.00 0.00 0.00 176.54 174.54 1xle h VAL 304 N 0.12 0.00 0.00 4.60 2.07 -0.72 0.78 116.25 123.09 1xle h VAL 304 Ca -0.07 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.42 1xle h VAL 304 Cb 1.64 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 1xle h VAL 304 CO 0.15 0.00 -0.17 -0.50 0.02 0.00 0.00 177.57 177.08 1xle h TRP 305 N -0.95 0.00 -0.25 1.57 -0.00 -1.55 -1.72 115.95 113.05 1xle h TRP 305 Ca -0.07 0.00 -0.03 0.00 -0.00 0.00 0.00 58.89 58.79 1xle h TRP 305 Cb 0.81 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 29.96 1xle h TRP 305 CO -0.21 0.17 0.02 -0.44 -0.00 0.00 0.00 178.44 177.98 1xle h ASP 306 N 0.00 0.42 -0.35 -3.49 3.32 -1.16 -1.12 116.42 114.03 1xle h ASP 306 Ca -0.00 -0.28 -0.04 0.00 0.02 0.00 0.00 57.03 56.72 1xle h ASP 306 Cb 0.32 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 1xle h ASP 306 CO 0.02 0.60 0.05 0.77 -1.72 0.00 0.00 179.24 178.96 1xle h SER 307 N 0.23 0.56 -0.89 6.45 4.64 0.13 0.17 113.55 124.84 1xle h SER 307 Ca 0.07 -0.26 0.03 0.00 -0.47 0.00 0.00 61.79 61.16 1xle h SER 307 Cb 0.37 -0.15 -0.05 0.00 -0.31 0.00 0.00 62.40 62.26 1xle h SER 307 CO 0.01 0.68 0.57 0.00 -0.87 0.00 0.00 176.83 177.22 1xle h ALA 308 N 0.90 1.17 -0.23 5.18 0.00 -1.32 -2.06 119.26 122.90 1xle h ALA 308 Ca 0.11 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1xle h ALA 308 Cb 0.36 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1xle h ALA 308 CO 0.01 0.43 -0.02 0.87 0.00 0.00 0.00 179.25 180.54 1xle h LYS 309 N 1.12 0.42 -0.96 0.00 1.79 -0.78 -3.26 116.57 114.89 1xle h LYS 309 Ca 0.35 -0.14 0.01 0.00 -2.18 0.00 0.00 60.65 58.69 1xle h LYS 309 Cb -0.00 -0.03 -0.05 0.00 -1.58 0.00 0.00 32.23 30.57 1xle h LYS 309 CO -0.11 0.62 0.64 0.00 -1.08 0.00 0.00 179.45 179.51 1xle h ALA 310 N 0.78 1.32 -0.20 3.86 0.00 -0.27 -0.73 119.26 124.01 1xle h ALA 310 Ca 0.06 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1xle h ALA 310 Cb 0.45 -0.38 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1xle h ALA 310 CO 0.02 0.63 -0.05 -0.91 0.00 0.00 0.00 179.25 178.93 1xle h ASN 311 N 1.29 -0.18 -0.29 0.00 2.35 -1.43 -0.36 115.58 116.97 1xle h ASN 311 Ca 0.35 0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 56.12 1xle h ASN 311 Cb -0.14 0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 1xle h ASN 311 CO -0.08 -0.06 0.01 0.24 -1.65 0.00 0.00 177.43 175.89 1xle h MET 312 N 0.00 0.50 0.14 0.81 2.86 -1.59 -2.21 114.93 115.45 1xle h MET 312 Ca 0.10 -0.15 0.02 0.00 -2.06 0.00 0.00 59.70 57.60 1xle h MET 312 Cb 0.15 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 1xle h MET 312 CO -0.21 0.64 -0.27 0.77 1.06 0.00 0.00 176.91 178.90 1xle h SER 313 N 0.30 -0.75 0.01 1.22 0.02 -0.72 -1.03 113.55 112.60 1xle h SER 313 Ca 0.08 0.08 0.03 0.00 -0.84 0.00 0.00 61.79 61.15 1xle h SER 313 Cb 0.40 0.28 -0.05 0.00 0.14 0.00 0.00 62.40 63.18 1xle h SER 313 CO 0.01 -0.36 -0.29 0.24 -1.14 0.00 0.00 176.83 175.29 1xle h MET 314 N -0.49 -0.43 -0.84 3.45 2.07 -1.09 0.74 114.93 118.34 1xle h MET 314 Ca 0.02 0.03 0.04 0.00 -2.07 0.00 0.00 59.70 57.72 1xle h MET 314 Cb 0.51 0.10 -0.05 0.00 -1.87 0.00 0.00 31.60 30.28 1xle h MET 314 CO -0.14 -0.28 0.54 -0.92 1.07 0.00 0.00 176.91 177.17 1xle h TYR 315 N -0.44 1.00 -0.00 -0.22 5.03 -1.16 0.16 116.97 121.33 1xle h TYR 315 Ca 0.06 0.03 -0.18 0.00 2.58 0.00 0.00 58.73 61.22 1xle h TYR 315 Cb 0.53 -0.33 -0.02 0.00 1.55 0.00 0.00 36.73 38.46 1xle h TYR 315 CO -0.32 0.57 -0.81 -0.07 -1.32 0.00 0.00 178.16 176.21 1xle h LEU 316 N 1.03 0.15 0.09 2.82 3.38 -0.28 -0.51 115.31 122.00 1xle h LEU 316 Ca 0.34 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 1xle h LEU 316 Cb 0.03 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1xle h LEU 316 CO -0.12 0.90 -0.04 -0.07 0.09 0.00 0.00 178.44 179.19 1xle h LEU 317 N 0.07 -0.10 -0.61 1.67 3.38 0.94 -2.48 115.31 118.18 1xle h LEU 317 Ca -0.03 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 57.78 1xle h LEU 317 Cb 1.42 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 42.16 1xle h LEU 317 CO 0.12 0.12 0.39 -0.07 0.09 0.00 0.00 178.44 179.08 1xle h LEU 318 N -0.33 0.65 -0.76 1.67 3.38 -0.70 -2.97 115.31 116.25 1xle h LEU 318 Ca -0.01 -0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.03 1xle h LEU 318 Cb 0.28 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.82 1xle h LEU 318 CO 0.02 0.46 0.43 0.50 0.09 0.00 0.00 178.44 179.94 1xle h LYS 319 N 0.77 0.74 0.11 1.13 3.64 -0.98 -2.05 116.57 119.93 1xle h LYS 319 Ca 0.24 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 1xle h LYS 319 Cb -0.03 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 1xle h LYS 319 CO -0.08 0.49 -0.10 1.49 -2.27 0.00 0.00 179.45 178.98 1xle h GLU 320 N 0.77 -0.22 -0.15 1.90 4.81 -1.30 -1.87 114.58 118.52 1xle h GLU 320 Ca 0.35 0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 59.47 1xle h GLU 320 Cb 0.27 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 1xle h GLU 320 CO -0.21 -0.15 -0.48 0.00 -0.73 0.00 0.00 179.01 177.44 1xle h ARG 321 N -0.23 0.39 0.00 1.92 3.08 -1.40 -2.56 114.38 115.58 1xle h ARG 321 Ca 0.00 -0.22 -0.06 0.00 0.07 0.00 0.00 59.98 59.77 1xle h ARG 321 Cb 0.21 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 1xle h ARG 321 CO -0.02 0.79 -0.30 0.00 -1.07 0.00 0.00 179.97 179.37 1xle h ALA 322 N 1.18 0.93 0.13 0.04 0.00 -1.32 -1.15 119.26 119.08 1xle h ALA 322 Ca 0.02 -0.27 -0.20 0.00 0.00 0.00 0.00 54.91 54.46 1xle h ALA 322 Cb 0.97 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.73 1xle h ALA 322 CO 0.08 0.37 -0.87 -0.07 0.00 0.00 0.00 179.25 178.76 1xle h LEU 323 N 0.00 0.53 -0.74 0.00 3.38 -1.27 -3.14 115.31 114.08 1xle h LEU 323 Ca -0.00 -0.92 -0.06 0.00 0.09 0.00 0.00 57.88 56.98 1xle h LEU 323 Cb 0.94 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 1xle h LEU 323 CO 0.04 1.41 0.22 0.00 0.09 0.00 0.00 178.44 180.20 1xle h ALA 324 N 0.13 0.97 0.43 1.53 0.00 -1.34 -2.84 119.26 118.14 1xle h ALA 324 Ca -0.15 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 1xle h ALA 324 Cb 1.67 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 1xle h ALA 324 CO 0.16 0.66 -0.25 0.35 0.00 0.00 0.00 179.25 180.18 1xle h PHE 325 N 1.10 -0.64 0.00 0.00 3.57 -1.32 -2.45 116.94 117.20 1xle h PHE 325 Ca 0.24 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.64 1xle h PHE 325 Cb 0.33 0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.28 1xle h PHE 325 CO 0.03 -0.39 -0.40 0.00 -2.23 0.00 0.00 178.31 175.32 1xle h ARG 326 N -0.64 0.00 0.00 1.11 2.47 -1.58 -3.19 114.38 112.55 1xle h ARG 326 Ca -0.05 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.64 1xle h ARG 326 Cb 0.51 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.83 1xle h ARG 326 CO 0.07 0.40 -0.11 0.00 0.56 0.00 0.00 179.97 180.88 1xle h ALA 327 N 1.60 0.94 -2.04 0.04 0.00 -1.48 -3.43 119.26 114.89 1xle h ALA 327 Ca -0.00 -0.10 -0.57 0.00 0.00 0.00 0.00 54.91 54.23 1xle h ALA 327 Cb 1.04 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.77 1xle h ALA 327 CO 0.05 0.14 0.94 0.34 0.00 0.00 0.00 179.25 180.73 1xle s ASP 328 N -6.19 6.78 0.47 0.00 2.15 -0.93 -4.95 116.67 114.02 1xle s ASP 328 Ca 0.05 1.41 0.21 0.00 0.43 0.00 0.00 52.55 54.66 1xle s ASP 328 Cb 0.06 -2.54 1.22 0.00 -0.30 0.00 0.00 42.92 41.37 1xle s ASP 328 CO 0.66 -0.95 1.92 1.55 -0.17 0.00 0.00 175.17 178.18 1xle h PRO 329 N 8.84 0.23 -0.24 4.34 0.13 -1.89 0.17 132.00 143.58 1xle h PRO 329 Ca -0.26 -0.01 -0.14 0.00 -0.87 0.00 0.00 66.00 64.72 1xle h PRO 329 Cb 1.10 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.17 1xle h PRO 329 CO 1.01 0.15 -0.43 0.93 -0.23 0.00 0.00 178.00 179.43 1xle h GLU 330 N 0.24 0.58 -0.21 0.86 5.08 -1.95 -1.99 114.58 117.19 1xle h GLU 330 Ca 0.38 -0.31 -0.09 0.00 -1.00 0.00 0.00 59.36 58.33 1xle h GLU 330 Cb 1.13 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.39 1xle h GLU 330 CO -0.08 0.90 -0.24 0.28 -1.00 0.00 0.00 179.01 178.87 1xle h VAL 331 N 0.48 1.33 -0.76 3.13 2.07 -1.29 -1.42 116.25 119.79 1xle h VAL 331 Ca 0.04 -1.42 -0.04 0.00 0.82 0.00 0.00 66.70 66.10 1xle h VAL 331 Cb 0.94 1.77 -0.03 0.00 -1.52 0.00 0.00 31.29 32.45 1xle h VAL 331 CO 0.08 0.43 0.32 1.56 0.02 0.00 0.00 177.57 179.99 1xle h GLN 332 N 0.20 1.13 -0.19 1.57 4.20 -1.20 -1.42 115.11 119.39 1xle h GLN 332 Ca 0.03 -0.20 -0.16 0.00 0.06 0.00 0.00 58.65 58.38 1xle h GLN 332 Cb 0.80 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.38 1xle h GLN 332 CO 0.06 0.91 -0.54 1.49 -0.67 0.00 0.00 178.83 180.08 1xle h GLU 333 N 1.09 0.57 -0.59 1.46 4.81 -1.32 -2.69 114.58 117.92 1xle h GLU 333 Ca 0.26 -0.36 -0.01 0.00 -0.13 0.00 0.00 59.36 59.12 1xle h GLU 333 Cb 0.19 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 1xle h GLU 333 CO -0.02 0.97 0.34 0.00 -0.73 0.00 0.00 179.01 179.57 1xle h ALA 334 N 0.96 0.75 -0.83 2.92 0.00 -1.03 -1.60 119.26 120.44 1xle h ALA 334 Ca 0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1xle h ALA 334 Cb 1.09 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 1xle h ALA 334 CO 0.10 0.25 0.44 0.52 0.00 0.00 0.00 179.25 180.56 1xle h MET 335 N 0.80 1.15 -0.31 0.00 2.86 -1.17 -1.95 114.93 116.30 1xle h MET 335 Ca 0.21 -0.14 -0.13 0.00 -2.06 0.00 0.00 59.70 57.58 1xle h MET 335 Cb 0.01 -0.23 -0.00 0.00 0.06 0.00 0.00 31.60 31.44 1xle h MET 335 CO -0.04 0.85 -0.31 -0.22 1.06 0.00 0.00 176.91 178.26 1xle h LYS 336 N 1.16 0.76 -0.03 1.72 3.64 -1.13 -0.70 116.57 121.99 1xle h LYS 336 Ca 0.29 -0.40 -0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1xle h LYS 336 Cb 0.04 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1xle h LYS 336 CO -0.05 1.03 0.02 1.15 -2.27 0.00 0.00 179.45 179.33 1xle h THR 337 N 0.53 1.07 0.00 1.00 2.02 -1.06 -2.94 112.91 113.53 1xle h THR 337 Ca 0.05 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 67.02 1xle h THR 337 Cb 0.88 1.15 0.00 0.00 -1.74 0.00 0.00 68.15 68.45 1xle h THR 337 CO 0.08 0.06 0.00 -1.20 0.37 0.00 0.00 175.52 174.83 1xle n SER 338 N -5.02 0.00 0.00 4.18 7.64 -0.75 -4.88 113.62 114.79 1xle n SER 338 Ca -0.07 0.48 0.00 0.00 1.01 0.00 0.00 58.87 60.29 1xle n SER 338 Cb 0.07 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.78 1xle n SER 338 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xle n GLY 339 N -0.29 0.46 0.22 0.23 0.00 -0.99 -4.97 105.19 99.85 1xle n GLY 339 Ca 0.03 -0.93 -0.09 0.00 0.00 0.00 0.00 46.02 45.02 1xle n GLY 339 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1xle h VAL 340 N 0.00 1.24 -0.14 1.61 2.07 -1.40 -2.53 116.25 117.10 1xle h VAL 340 Ca 0.00 -0.83 -0.18 0.00 0.82 0.00 0.00 66.70 66.51 1xle h VAL 340 Cb 0.39 0.96 0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1xle h VAL 340 CO 0.00 0.29 -0.61 -0.26 0.02 0.00 0.00 177.57 177.01 1xle h PHE 341 N 0.56 0.88 -0.69 1.57 0.04 -1.90 -3.19 116.94 114.21 1xle h PHE 341 Ca 0.13 -0.38 0.14 0.00 2.80 0.00 0.00 57.97 60.66 1xle h PHE 341 Cb 0.34 -0.14 -0.04 0.00 2.20 0.00 0.00 35.95 38.31 1xle h PHE 341 CO 0.02 1.19 0.46 1.49 -0.60 0.00 0.00 178.31 180.87 1xle h GLU 342 N 0.33 0.35 0.00 1.51 4.81 -1.87 -1.40 114.58 118.31 1xle h GLU 342 Ca -0.04 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 1xle h GLU 342 Cb 1.25 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.54 1xle h GLU 342 CO 0.13 0.23 -0.10 1.25 -0.73 0.00 0.00 179.01 179.79 1xle h LEU 343 N 0.36 0.00 -1.58 1.64 5.85 -1.44 -2.29 115.31 117.86 1xle h LEU 343 Ca 0.33 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 59.01 1xle h LEU 343 Cb 0.79 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 1xle h LEU 343 CO -0.09 0.10 -0.21 1.23 -0.34 0.00 0.00 178.44 179.13 1xle h GLY 344 N 0.51 0.00 -3.49 3.75 0.00 -1.38 -3.44 103.07 99.03 1xle h GLY 344 Ca -0.00 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.84 1xle h GLY 344 CO 0.01 0.00 0.38 -0.54 0.00 0.00 0.00 176.54 176.39 1xle s GLU 345 N -4.10 4.69 0.70 4.80 2.02 -0.86 -5.00 118.70 120.94 1xle s GLU 345 Ca -0.02 1.52 -0.16 0.00 0.02 0.00 0.00 54.97 56.33 1xle s GLU 345 Cb 0.13 -3.08 0.02 0.00 0.10 0.00 0.00 34.13 31.31 1xle s GLU 345 CO 0.64 0.34 1.21 0.95 0.02 0.00 0.00 175.26 178.41 1xle s THR 346 N -1.33 2.40 0.07 3.63 -4.23 -1.26 -4.92 115.64 110.00 1xle s THR 346 Ca 0.45 0.20 -0.18 0.00 -1.18 0.00 0.00 61.69 60.99 1xle s THR 346 Cb -0.25 -2.82 -0.11 0.00 1.34 0.00 0.00 72.50 70.66 1xle s THR 346 CO 0.31 -0.10 1.39 0.74 -0.54 0.00 0.00 174.62 176.42 1xle h THR 347 N -0.08 1.32 -3.43 3.99 2.02 -1.94 -3.44 112.91 111.36 1xle h THR 347 Ca -0.48 -1.36 -0.54 0.00 0.77 0.00 0.00 66.41 64.80 1xle h THR 347 Cb 1.29 1.72 -0.04 0.00 -1.74 0.00 0.00 68.15 69.39 1xle h THR 347 CO 0.51 0.42 0.05 -0.76 0.37 0.00 0.00 175.52 176.11 1xle s LEU 348 N -9.05 4.45 0.39 2.58 1.43 -1.26 -5.07 118.68 112.14 1xle s LEU 348 Ca -0.13 1.37 -0.25 0.00 -1.03 0.00 0.00 54.13 54.09 1xle s LEU 348 Cb 0.07 -3.28 -0.09 0.00 0.03 0.00 0.00 46.19 42.92 1xle s LEU 348 CO 0.79 0.15 1.07 0.20 0.23 0.00 0.00 176.35 178.79 1xle s ASN 349 N -1.40 6.77 -0.48 2.29 0.01 -1.26 -4.90 114.94 115.97 1xle s ASN 349 Ca 0.37 2.11 -0.45 0.00 -0.71 0.00 0.00 52.86 54.17 1xle s ASN 349 Cb -0.19 -2.59 -0.19 0.00 0.41 0.00 0.00 41.25 38.69 1xle s ASN 349 CO 0.21 -0.49 1.76 0.00 -1.51 0.00 0.00 177.10 177.07 1xle n ALA 350 N 0.09 -0.83 0.00 0.60 0.00 -1.26 -0.08 120.51 119.03 1xle n ALA 350 Ca 0.04 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1xle n ALA 350 Cb 0.49 -2.00 0.00 0.00 0.00 0.00 0.00 19.45 17.94 1xle n ALA 350 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xle n GLY 351 N 4.92 3.25 3.72 0.00 0.00 -1.26 -5.01 105.19 110.81 1xle n GLY 351 Ca 0.37 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.97 1xle n GLY 351 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xle s GLU 352 N -0.51 4.39 0.60 1.61 2.12 0.89 -5.02 118.70 122.79 1xle s GLU 352 Ca 0.00 1.96 -0.00 0.00 0.36 0.00 0.00 54.97 57.29 1xle s GLU 352 Cb 0.00 -3.26 0.05 0.00 0.26 0.00 0.00 34.13 31.19 1xle s GLU 352 CO 0.00 -0.28 0.85 -1.54 -0.54 0.00 0.00 175.26 173.75 1xle s SER 353 N 0.72 5.04 0.08 -1.70 1.04 -1.26 -4.81 113.70 112.81 1xle s SER 353 Ca 0.59 0.01 -0.22 0.00 0.48 0.00 0.00 55.95 56.81 1xle s SER 353 Cb -0.34 -0.77 -0.13 0.00 0.10 0.00 0.00 66.02 64.88 1xle s SER 353 CO 0.33 -1.34 1.66 0.00 0.98 0.00 0.00 173.24 174.87 1xle h ALA 354 N -0.14 0.09 -0.32 5.32 0.00 -2.00 -2.01 119.26 120.19 1xle h ALA 354 Ca -0.42 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.50 1xle h ALA 354 Cb 1.30 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 19.00 1xle h ALA 354 CO 0.52 -0.36 -0.08 0.00 0.00 0.00 0.00 179.25 179.33 1xle h ALA 355 N 0.93 0.22 -0.28 0.00 0.00 -2.01 -2.77 119.26 115.34 1xle h ALA 355 Ca 0.02 0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.12 1xle h ALA 355 Cb 0.10 0.24 -0.08 0.00 0.00 0.00 0.00 17.79 18.05 1xle h ALA 355 CO -0.00 -0.46 -0.37 -0.44 0.00 0.00 0.00 179.25 177.97 1xle h ASP 356 N 0.00 -1.20 -0.33 0.00 3.32 -1.76 -2.93 116.42 113.53 1xle h ASP 356 Ca 0.16 0.18 -0.04 0.00 0.02 0.00 0.00 57.03 57.35 1xle h ASP 356 Cb 0.24 0.53 -0.02 0.00 0.22 0.00 0.00 39.33 40.29 1xle h ASP 356 CO -0.33 -0.37 0.07 0.25 -1.72 0.00 0.00 179.24 177.15 1xle h LEU 357 N -0.36 0.57 -0.53 1.55 5.85 -1.17 -0.69 115.31 120.54 1xle h LEU 357 Ca 0.13 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.80 1xle h LEU 357 Cb 0.57 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.41 1xle h LEU 357 CO -0.48 0.59 0.26 0.24 -0.34 0.00 0.00 178.44 178.72 1xle h MET 358 N 0.60 0.49 0.00 1.25 2.86 -1.30 -2.34 114.93 116.49 1xle h MET 358 Ca 0.13 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1xle h MET 358 Cb 0.27 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 31.82 1xle h MET 358 CO 0.00 0.33 0.00 -0.91 1.06 0.00 0.00 176.91 177.39 1xle h ASN 359 N 0.51 0.00 -2.30 1.22 2.35 -1.56 -3.43 115.58 112.37 1xle h ASN 359 Ca 0.24 0.00 -0.58 0.00 -0.55 0.00 0.00 56.30 55.40 1xle h ASN 359 Cb 0.16 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 38.42 1xle h ASN 359 CO -0.17 0.00 0.94 -0.62 -1.65 0.00 0.00 177.43 175.93 1xle s ASP 360 N -5.13 6.23 0.29 5.81 2.15 -0.27 -4.92 116.67 120.83 1xle s ASP 360 Ca 0.08 -0.84 -0.00 0.00 0.43 0.00 0.00 52.55 52.22 1xle s ASP 360 Cb 0.09 -2.51 0.67 0.00 -0.30 0.00 0.00 42.92 40.88 1xle s ASP 360 CO 0.59 -1.63 1.60 -1.28 -0.17 0.00 0.00 175.17 174.28 1xle h SER 361 N 9.79 -0.36 0.89 -0.34 0.87 -1.84 0.53 113.55 123.10 1xle h SER 361 Ca -0.20 0.24 -0.04 0.00 -1.23 0.00 0.00 61.79 60.56 1xle h SER 361 Cb 1.05 0.41 -0.01 0.00 -0.44 0.00 0.00 62.40 63.41 1xle h SER 361 CO 1.26 -0.28 -0.21 0.00 -0.53 0.00 0.00 176.83 177.07 1xle h ALA 362 N 1.88 1.03 0.00 6.23 0.00 -1.91 1.15 119.26 127.64 1xle h ALA 362 Ca 0.55 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 55.13 1xle h ALA 362 Cb 1.09 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1xle h ALA 362 CO -0.81 0.26 -0.90 0.77 0.00 0.00 0.00 179.25 178.57 1xle h SER 363 N 0.00 0.00 0.00 0.00 0.02 -1.20 -3.32 113.55 109.05 1xle h SER 363 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1xle h SER 363 Cb 0.71 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.25 1xle h SER 363 CO 0.03 0.53 0.00 0.33 -1.14 0.00 0.00 176.83 176.58 1xle n PHE 364 N -3.07 0.00 -0.14 3.45 7.35 -1.04 -4.72 117.46 119.29 1xle n PHE 364 Ca -0.03 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.55 1xle n PHE 364 Cb 0.78 0.02 -0.08 0.00 0.35 0.00 0.00 39.48 40.55 1xle n PHE 364 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1xle h ALA 365 N 0.00 -0.66 -0.66 3.13 0.00 -1.67 -1.93 119.26 117.48 1xle h ALA 365 Ca 0.00 0.01 -0.33 0.00 0.00 0.00 0.00 54.91 54.59 1xle h ALA 365 Cb 0.00 1.08 -0.19 0.00 0.00 0.00 0.00 17.79 18.67 1xle h ALA 365 CO 0.00 -0.89 0.41 0.41 0.00 0.00 0.00 179.25 179.19 1xle n GLY 366 N -1.29 3.62 3.74 0.00 0.00 0.39 -4.96 105.19 106.69 1xle n GLY 366 Ca -0.02 -0.74 -0.41 0.00 0.00 0.00 0.00 46.02 44.85 1xle n GLY 366 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1xle s PHE 367 N -2.26 3.77 -0.55 1.61 5.36 -0.73 -4.73 117.98 120.45 1xle s PHE 367 Ca 0.39 1.65 -0.17 0.00 -0.96 0.00 0.00 56.93 57.84 1xle s PHE 367 Cb 0.33 -2.95 0.11 0.00 -0.34 0.00 0.00 43.02 40.16 1xle s PHE 367 CO 0.08 0.23 0.58 0.34 -1.46 0.00 0.00 175.22 174.99 1xle s ASP 368 N -0.00 6.19 0.03 6.13 2.15 -1.26 -4.86 116.67 125.04 1xle s ASP 368 Ca 0.43 -1.51 -0.21 0.00 0.43 0.00 0.00 52.55 51.69 1xle s ASP 368 Cb -0.22 -2.25 -0.15 0.00 -0.30 0.00 0.00 42.92 40.00 1xle s ASP 368 CO 0.27 -0.94 1.34 0.00 -0.17 0.00 0.00 175.17 175.67 1xle h ALA 369 N 9.00 0.19 -0.93 3.66 0.00 -1.96 -2.48 119.26 126.74 1xle h ALA 369 Ca -0.29 -0.31 0.12 0.00 0.00 0.00 0.00 54.91 54.43 1xle h ALA 369 Cb 1.10 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.76 1xle h ALA 369 CO 1.04 0.05 0.55 0.93 0.00 0.00 0.00 179.25 181.82 1xle h GLU 370 N -0.07 0.84 -0.04 0.00 4.39 -1.99 -0.16 114.58 117.56 1xle h GLU 370 Ca 0.02 -0.05 -0.22 0.00 0.34 0.00 0.00 59.36 59.46 1xle h GLU 370 Cb 0.64 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 1xle h GLU 370 CO 0.03 0.56 -0.87 0.00 -1.16 0.00 0.00 179.01 177.57 1xle h ALA 371 N 1.52 0.42 -0.43 3.43 0.00 -1.94 -3.27 119.26 118.98 1xle h ALA 371 Ca 0.47 -0.67 -0.13 0.00 0.00 0.00 0.00 54.91 54.57 1xle h ALA 371 Cb 0.49 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1xle h ALA 371 CO -0.28 0.78 -0.27 0.00 0.00 0.00 0.00 179.25 179.49 1xle h ALA 372 N 0.76 0.72 0.00 0.00 0.00 -0.83 -2.69 119.26 117.22 1xle h ALA 372 Ca -0.07 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1xle h ALA 372 Cb 1.49 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1xle h ALA 372 CO 0.15 0.67 0.06 0.00 0.00 0.00 0.00 179.25 180.13 1xle n ALA 373 N -2.52 0.91 0.06 0.00 0.00 -0.16 -2.31 120.51 116.49 1xle n ALA 373 Ca -0.00 0.04 -0.20 0.00 0.00 0.00 0.00 53.44 53.28 1xle n ALA 373 Cb 0.48 -0.96 -0.10 0.00 0.00 0.00 0.00 19.45 18.86 1xle n ALA 373 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1xle h GLU 374 N 0.00 0.63 -2.58 0.00 4.39 -1.59 -3.47 114.58 111.97 1xle h GLU 374 Ca 0.00 -0.73 -0.34 0.00 0.34 0.00 0.00 59.36 58.64 1xle h GLU 374 Cb 0.11 0.22 0.02 0.00 -0.10 0.00 0.00 28.75 29.01 1xle h GLU 374 CO 0.00 1.31 0.01 -2.13 -1.16 0.00 0.00 179.01 177.04 1xle n ARG 375 N -3.81 0.00 -3.47 2.33 0.63 -0.98 -4.90 116.66 106.46 1xle n ARG 375 Ca -0.11 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.40 1xle n ARG 375 Cb 0.91 -0.63 -0.10 0.00 0.45 0.00 0.00 32.46 33.09 1xle n ARG 375 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1xle s ASN 376 N -0.03 6.10 0.22 6.15 2.47 -1.26 -4.92 114.94 123.67 1xle s ASN 376 Ca 0.38 -0.58 0.09 0.00 0.42 0.00 0.00 52.86 53.18 1xle s ASN 376 Cb -0.54 -2.16 0.15 0.00 -1.45 0.00 0.00 41.25 37.25 1xle s ASN 376 CO 0.24 -0.35 1.49 -0.26 -3.72 0.00 0.00 177.10 174.51 1xle h PHE 377 N 8.55 0.00 -4.99 0.43 0.04 -1.90 -3.46 116.94 115.62 1xle h PHE 377 Ca -0.29 0.00 -0.28 0.00 2.80 0.00 0.00 57.97 60.20 1xle h PHE 377 Cb 1.14 0.00 0.13 0.00 2.20 0.00 0.00 35.95 39.42 1xle h PHE 377 CO 0.62 0.76 -0.62 0.00 -0.60 0.00 0.00 178.31 178.47 1xle n ALA 378 N -2.39 -1.55 0.13 2.45 0.00 -1.26 -3.45 120.51 114.43 1xle n ALA 378 Ca -0.01 0.02 0.02 0.00 0.00 0.00 0.00 53.44 53.47 1xle n ALA 378 Cb 0.74 -2.52 0.02 0.00 0.00 0.00 0.00 19.45 17.68 1xle n ALA 378 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1xle h PHE 379 N -1.68 0.00 0.01 0.00 0.04 -1.95 -3.01 116.94 110.35 1xle h PHE 379 Ca -0.48 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.29 1xle h PHE 379 Cb 1.28 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.43 1xle h PHE 379 CO 0.37 0.54 -0.01 0.82 -0.60 0.00 0.00 178.31 179.43 1xle h ILE 380 N 0.00 1.40 -0.48 -0.55 2.04 -1.99 0.47 117.51 118.40 1xle h ILE 380 Ca -0.01 -1.24 0.04 0.00 1.00 0.00 0.00 64.86 64.65 1xle h ILE 380 Cb 1.41 2.23 -0.04 0.00 -0.74 0.00 0.00 36.82 39.68 1xle h ILE 380 CO 0.07 0.32 0.25 -0.09 0.00 0.00 0.00 178.15 178.70 1xle h ARG 381 N -0.55 0.48 -0.32 2.37 2.43 -1.96 -0.60 114.38 116.24 1xle h ARG 381 Ca -0.00 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 1xle h ARG 381 Cb 0.53 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.96 1xle h ARG 381 CO 0.00 0.32 0.09 1.25 -1.51 0.00 0.00 179.97 180.13 1xle h LEU 382 N 0.50 0.41 -0.20 3.80 5.85 -1.47 -2.11 115.31 122.08 1xle h LEU 382 Ca 0.21 -0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.79 1xle h LEU 382 Cb 0.09 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.02 1xle h LEU 382 CO -0.13 0.40 -0.23 -1.13 -0.34 0.00 0.00 178.44 177.01 1xle h ASN 383 N 0.45 0.56 -0.88 1.25 -1.24 0.57 -2.99 115.58 113.30 1xle h ASN 383 Ca 0.11 -0.49 0.14 0.00 0.71 0.00 0.00 56.30 56.76 1xle h ASN 383 Cb 0.15 -0.16 -0.07 0.00 0.73 0.00 0.00 38.32 38.97 1xle h ASN 383 CO -0.01 0.94 0.57 -0.61 -1.29 0.00 0.00 177.43 177.03 1xle h GLN 384 N 0.19 0.68 -0.49 6.67 5.75 -0.75 -1.86 115.11 125.30 1xle h GLN 384 Ca 0.03 -0.04 -0.13 0.00 -0.15 0.00 0.00 58.65 58.36 1xle h GLN 384 Cb 0.79 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 29.17 1xle h GLN 384 CO 0.06 0.45 -0.20 -0.07 -2.65 0.00 0.00 178.83 176.42 1xle h LEU 385 N 0.70 1.00 -0.25 -2.39 3.38 -1.33 -2.11 115.31 114.30 1xle h LEU 385 Ca 0.43 -0.37 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 1xle h LEU 385 Cb 0.67 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 1xle h LEU 385 CO -0.19 1.16 -0.26 0.00 0.09 0.00 0.00 178.44 179.24 1xle h ALA 386 N 0.91 0.37 -0.71 1.53 0.00 -1.21 -2.97 119.26 117.19 1xle h ALA 386 Ca 0.12 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1xle h ALA 386 Cb 0.77 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 1xle h ALA 386 CO 0.06 0.36 0.23 0.82 0.00 0.00 0.00 179.25 180.72 1xle h ILE 387 N 0.34 1.26 -0.05 0.00 1.08 -1.38 -1.46 117.51 117.29 1xle h ILE 387 Ca 0.04 -0.87 -0.08 0.00 -0.39 0.00 0.00 64.86 63.55 1xle h ILE 387 Cb 0.82 0.48 -0.01 0.00 -3.07 0.00 0.00 36.82 35.04 1xle h ILE 387 CO 0.06 0.34 -0.36 -0.33 -0.69 0.00 0.00 178.15 177.18 1xle h GLU 388 N 1.04 0.09 -0.13 2.37 5.08 -1.44 0.11 114.58 121.70 1xle h GLU 388 Ca 0.23 -0.04 -0.23 0.00 -1.00 0.00 0.00 59.36 58.32 1xle h GLU 388 Cb 0.29 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.55 1xle h GLU 388 CO -0.01 0.45 -0.81 0.45 -1.00 0.00 0.00 179.01 178.08 1xle h HIS 389 N 0.08 1.06 -0.21 4.33 3.86 -1.31 -1.71 115.15 121.25 1xle h HIS 389 Ca 0.01 -0.48 -0.16 0.00 -1.16 0.00 0.00 60.37 58.58 1xle h HIS 389 Cb 0.68 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.98 1xle h HIS 389 CO 0.00 1.31 -0.51 1.25 0.86 0.00 0.00 177.93 180.85 1xle h LEU 390 N 0.52 0.65 0.00 2.43 5.85 -1.06 -3.05 115.31 120.65 1xle h LEU 390 Ca -0.06 -0.33 0.00 0.00 0.84 0.00 0.00 57.88 58.33 1xle h LEU 390 Cb 1.44 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.29 1xle h LEU 390 CO 0.17 1.04 0.00 0.18 -0.34 0.00 0.00 178.44 179.49 1xle n LEU 391 N -3.98 0.00 -0.06 2.25 4.77 0.36 -4.92 117.00 115.42 1xle n LEU 391 Ca -0.03 0.41 -0.01 0.00 -0.03 0.00 0.00 56.01 56.35 1xle n LEU 391 Cb 0.58 -0.41 -0.00 0.00 -2.33 0.00 0.00 43.42 41.26 1xle n LEU 391 CO 0.47 -0.07 -0.01 0.61 -1.33 0.00 0.00 177.39 177.06 1xle n GLY 392 N 0.91 0.49 0.17 -0.72 0.00 -1.09 -4.97 105.19 99.98 1xle n GLY 392 Ca 0.08 -0.41 -0.13 0.00 0.00 0.00 0.00 46.02 45.56 1xle n GLY 392 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1xle h SER 393 N 0.00 0.54 0.00 1.61 0.87 -1.56 -3.49 113.55 111.52 1xle h SER 393 Ca -0.02 -0.44 0.00 0.00 -1.23 0.00 0.00 61.79 60.10 1xle h SER 393 Cb 0.11 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 61.92 1xle h SER 393 CO 0.02 0.86 0.00 0.54 -0.53 0.00 0.00 176.83 177.73