#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4xia s GLN 3 N 0.00 1.58 0.59 7.34 1.11 -1.26 -4.92 119.66 124.10 4xia s GLN 3 Ca 0.00 -0.28 -0.17 0.00 0.01 0.00 0.00 55.36 54.92 4xia s GLN 3 Cb 0.00 -1.61 -0.04 0.00 -1.01 0.00 0.00 33.01 30.36 4xia s GLN 3 CO 0.00 -0.25 1.09 -1.25 0.01 0.00 0.00 175.29 174.89 4xia s PRO 4 N 1.64 3.22 0.06 2.91 0.04 -1.26 -5.04 135.00 136.57 4xia s PRO 4 Ca 0.04 1.36 0.01 0.00 0.04 0.00 0.00 61.00 62.45 4xia s PRO 4 Cb -0.13 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.37 4xia s PRO 4 CO -0.08 -0.91 -0.06 0.95 0.04 0.00 0.00 177.00 176.95 4xia s THR 5 N -2.23 0.48 0.57 1.26 -4.23 -1.26 -4.69 115.64 105.53 4xia s THR 5 Ca 0.67 -1.59 0.41 0.00 -1.18 0.00 0.00 61.69 60.01 4xia s THR 5 Cb -0.19 -1.23 0.61 0.00 1.34 0.00 0.00 72.50 73.03 4xia s THR 5 CO 0.34 -0.75 1.60 -0.65 -0.54 0.00 0.00 174.62 174.63 4xia h PRO 6 N 3.56 0.00 0.00 3.99 0.11 -1.81 -0.60 132.00 137.25 4xia h PRO 6 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 4xia h PRO 6 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 4xia h PRO 6 CO 0.57 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.36 4xia h ALA 7 N 1.05 1.00 0.00 -0.75 0.00 -1.97 -2.81 119.26 115.78 4xia h ALA 7 Ca 0.72 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.62 4xia h ALA 7 Cb 3.08 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 20.87 4xia h ALA 7 CO -0.01 0.00 -0.02 -0.44 0.00 0.00 0.00 179.25 178.78 4xia h ASP 8 N 0.00 0.00 -5.99 0.00 3.45 -1.48 -3.47 116.42 108.93 4xia h ASP 8 Ca 0.00 0.00 -0.41 0.00 0.43 0.00 0.00 57.03 57.05 4xia h ASP 8 Cb 0.43 0.00 0.08 0.00 -0.56 0.00 0.00 39.33 39.28 4xia h ASP 8 CO 0.00 0.02 -0.74 1.41 -1.57 0.00 0.00 179.24 178.36 4xia n HIS 9 N -3.13 -2.46 -2.79 4.55 8.25 -1.06 -4.71 115.22 113.87 4xia n HIS 9 Ca 0.00 0.95 -0.42 0.00 -0.26 0.00 0.00 57.72 57.99 4xia n HIS 9 Cb 0.30 -4.64 -0.03 0.00 1.12 0.00 0.00 29.99 26.74 4xia n HIS 9 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 4xia s PHE 10 N -3.37 3.41 0.10 4.41 0.08 -1.26 -1.05 117.98 120.30 4xia s PHE 10 Ca 0.43 1.37 0.09 0.00 0.12 0.00 0.00 56.93 58.94 4xia s PHE 10 Cb -0.20 -3.12 -0.03 0.00 -0.57 0.00 0.00 43.02 39.10 4xia s PHE 10 CO 0.77 -0.31 -0.22 0.95 -0.10 0.00 0.00 175.22 176.31 4xia s THR 11 N 2.43 1.82 0.04 0.64 -4.23 -0.75 -0.50 115.64 115.10 4xia s THR 11 Ca 0.42 -1.54 0.04 0.00 -1.18 0.00 0.00 61.69 59.43 4xia s THR 11 Cb -0.16 -1.63 -0.02 0.00 1.34 0.00 0.00 72.50 72.02 4xia s THR 11 CO 0.12 0.01 -0.11 -0.36 -0.54 0.00 0.00 174.62 173.74 4xia s PHE 12 N -1.09 0.97 0.38 3.99 0.40 -1.11 -1.89 117.98 119.62 4xia s PHE 12 Ca 0.08 -0.38 -0.14 0.00 -0.60 0.00 0.00 56.93 55.89 4xia s PHE 12 Cb -0.10 -0.57 -0.08 0.00 0.51 0.00 0.00 43.02 42.78 4xia s PHE 12 CO 0.04 -0.00 0.79 0.20 0.70 0.00 0.00 175.22 176.95 4xia s GLY 13 N -1.23 2.18 0.37 4.36 0.00 -1.24 -1.32 107.32 110.43 4xia s GLY 13 Ca -0.02 -0.00 0.09 0.00 0.00 0.00 0.00 44.72 44.78 4xia s GLY 13 CO 0.01 0.21 1.88 -2.00 0.00 0.00 0.00 173.10 173.19 4xia h LEU 14 N 1.76 0.25 0.00 0.66 5.85 -1.29 -1.61 115.31 120.93 4xia h LEU 14 Ca -0.48 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.19 4xia h LEU 14 Cb 1.18 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.14 4xia h LEU 14 CO 0.64 0.44 0.00 -2.67 -0.34 0.00 0.00 178.44 176.51 4xia n TRP 15 N -4.23 0.00 -0.00 1.25 2.14 -1.26 -2.11 117.44 113.22 4xia n TRP 15 Ca -0.01 0.00 -0.00 0.00 2.07 0.00 0.00 57.50 59.56 4xia n TRP 15 Cb 0.30 -0.38 -0.00 0.00 -0.81 0.00 0.00 31.31 30.41 4xia n TRP 15 CO 0.00 0.00 0.00 1.79 2.07 0.00 0.00 177.69 181.55 4xia h THR 16 N 0.00 0.00 0.00 -1.67 1.35 -1.48 -3.05 112.91 108.05 4xia h THR 16 Ca 0.00 -0.27 -0.06 0.00 -0.55 0.00 0.00 66.41 65.54 4xia h THR 16 Cb 0.28 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 66.69 4xia h THR 16 CO 0.00 0.00 -0.28 -0.37 -0.25 0.00 0.00 175.52 174.62 4xia h VAL 17 N -0.29 1.01 0.00 6.82 -1.51 -1.69 -2.51 116.25 118.08 4xia h VAL 17 Ca -0.00 -1.01 0.00 0.00 -1.23 0.00 0.00 66.70 64.45 4xia h VAL 17 Cb 0.02 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 30.76 4xia h VAL 17 CO 0.00 0.27 0.00 0.61 -1.23 0.00 0.00 177.57 177.23 4xia n GLY 18 N -0.52 -1.41 3.64 5.19 0.00 -0.90 -4.81 105.19 106.39 4xia n GLY 18 Ca -0.02 -0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 4xia n GLY 18 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 4xia s TRP 19 N -3.00 2.30 -0.99 1.61 -0.00 -0.95 -4.55 118.94 113.36 4xia s TRP 19 Ca 0.13 0.60 0.28 0.00 -0.00 0.00 0.00 56.10 57.10 4xia s TRP 19 Cb 0.17 -3.85 0.98 0.00 -0.00 0.00 0.00 33.47 30.77 4xia s TRP 19 CO 0.48 -2.74 1.75 2.41 -0.00 0.00 0.00 176.95 178.85 4xia n THR 20 N 5.94 0.01 0.00 5.86 -1.04 -1.26 -4.79 114.28 119.00 4xia n THR 20 Ca 0.17 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.17 4xia n THR 20 Cb 0.45 -0.25 0.00 0.00 -1.82 0.00 0.00 70.33 68.71 4xia n THR 20 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 4xia n GLY 21 N 1.50 0.93 3.75 3.41 0.00 -1.26 0.70 105.19 114.21 4xia n GLY 21 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 4xia n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4xia s ALA 22 N -2.00 3.41 0.11 4.61 0.00 -1.26 -4.37 121.76 122.25 4xia s ALA 22 Ca 0.00 0.90 0.01 0.00 0.00 0.00 0.00 51.96 52.87 4xia s ALA 22 Cb 0.00 -3.36 -0.00 0.00 0.00 0.00 0.00 23.12 19.76 4xia s ALA 22 CO 0.00 -0.23 0.04 -0.40 0.00 0.00 0.00 175.76 175.17 4xia n ASP 23 N 1.77 0.98 0.29 0.00 5.68 -0.84 -4.94 116.55 119.50 4xia n ASP 23 Ca 0.01 -1.56 0.17 0.00 -0.50 0.00 0.00 54.79 52.91 4xia n ASP 23 Cb 0.45 0.27 0.88 0.00 -1.14 0.00 0.00 41.12 41.58 4xia n ASP 23 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 4xia h PRO 24 N 0.00 0.00 -0.12 0.11 0.11 -2.01 -3.18 132.00 126.91 4xia h PRO 24 Ca -0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.03 4xia h PRO 24 Cb 0.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.42 4xia h PRO 24 CO 0.13 0.05 0.00 1.19 -0.21 0.00 0.00 178.00 179.16 4xia n PHE 25 N -3.38 0.28 -3.63 0.65 3.01 -1.26 -5.07 117.46 108.07 4xia n PHE 25 Ca -0.02 -0.73 -0.03 0.00 1.01 0.00 0.00 57.45 57.68 4xia n PHE 25 Cb 0.19 -0.13 -0.01 0.00 -0.01 0.00 0.00 39.48 39.51 4xia n PHE 25 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 4xia s GLY 26 N -1.76 -0.35 0.66 1.37 0.00 -1.20 -5.17 107.32 100.88 4xia s GLY 26 Ca 0.23 0.80 -0.02 0.00 0.00 0.00 0.00 44.72 45.72 4xia s GLY 26 CO 0.06 0.22 0.93 -1.34 0.00 0.00 0.00 173.10 172.97 4xia s VAL 27 N -2.83 2.36 0.58 1.40 -7.23 -1.26 -1.99 120.40 111.43 4xia s VAL 27 Ca 0.10 -0.51 -0.20 0.00 -1.81 0.00 0.00 61.98 59.56 4xia s VAL 27 Cb 0.01 -2.85 -0.04 0.00 0.56 0.00 0.00 36.38 34.06 4xia s VAL 27 CO -0.03 0.00 1.34 0.00 -0.31 0.00 0.00 175.10 176.10 4xia n ALA 28 N -2.72 1.45 0.30 1.32 0.00 -1.26 -4.32 120.51 115.29 4xia n ALA 28 Ca 0.11 0.08 0.03 0.00 0.00 0.00 0.00 53.44 53.66 4xia n ALA 28 Cb 0.60 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.70 4xia n ALA 28 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 4xia n THR 29 N -1.33 0.00 -4.23 0.00 -2.24 0.22 -4.92 114.28 101.79 4xia n THR 29 Ca 0.12 -0.44 -0.15 0.00 -2.27 0.00 0.00 64.05 61.32 4xia n THR 29 Cb 0.46 1.08 -0.10 0.00 -2.10 0.00 0.00 70.33 69.67 4xia n THR 29 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 4xia s ARG 30 N -1.03 0.99 0.56 -0.78 0.52 -0.82 -5.01 118.95 113.37 4xia s ARG 30 Ca 0.06 -1.32 -0.17 0.00 -0.52 0.00 0.00 55.73 53.78 4xia s ARG 30 Cb 0.05 -0.65 -0.05 0.00 0.52 0.00 0.00 34.95 34.82 4xia s ARG 30 CO 0.16 0.10 1.04 0.00 0.02 0.00 0.00 175.30 176.62 4xia s ALA 31 N -2.81 2.81 0.46 2.13 0.00 -1.26 -4.79 121.76 118.30 4xia s ALA 31 Ca 0.12 0.41 -0.25 0.00 0.00 0.00 0.00 51.96 52.24 4xia s ALA 31 Cb -0.01 -3.22 -0.08 0.00 0.00 0.00 0.00 23.12 19.81 4xia s ALA 31 CO 0.01 -0.62 1.36 0.09 0.00 0.00 0.00 175.76 176.60 4xia n ASN 32 N -1.73 2.92 -4.66 0.00 4.13 -1.26 -4.90 115.26 109.76 4xia n ASN 32 Ca 0.09 1.09 -0.38 0.00 1.68 0.00 0.00 54.58 57.05 4xia n ASN 32 Cb 0.53 -1.56 -0.08 0.00 -1.54 0.00 0.00 39.78 37.13 4xia n ASN 32 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 4xia s LEU 33 N -2.48 4.13 0.23 3.41 2.96 -1.26 -5.05 118.68 120.61 4xia s LEU 33 Ca 0.63 0.40 -0.30 0.00 -0.22 0.00 0.00 54.13 54.65 4xia s LEU 33 Cb -0.46 -2.43 -0.09 0.00 0.50 0.00 0.00 46.19 43.71 4xia s LEU 33 CO 0.56 -0.07 1.33 -0.62 -1.32 0.00 0.00 176.35 176.23 4xia s ASP 34 N 1.15 6.84 0.49 3.68 2.15 -1.26 -4.90 116.67 124.83 4xia s ASP 34 Ca 0.16 2.50 0.26 0.00 0.43 0.00 0.00 52.55 55.90 4xia s ASP 34 Cb -0.15 -2.62 1.26 0.00 -0.30 0.00 0.00 42.92 41.11 4xia s ASP 34 CO 0.08 -0.55 1.98 1.55 -0.17 0.00 0.00 175.17 178.05 4xia h PRO 35 N 4.96 0.00 -0.19 4.34 0.13 -1.96 -1.56 132.00 137.71 4xia h PRO 35 Ca -0.46 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.47 4xia h PRO 35 Cb 1.22 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.35 4xia h PRO 35 CO 0.75 0.16 -0.69 0.28 -0.23 0.00 0.00 178.00 178.27 4xia h VAL 36 N 0.00 1.28 -0.83 1.56 2.07 -1.93 -1.41 116.25 116.99 4xia h VAL 36 Ca -0.00 -1.89 -0.04 0.00 0.82 0.00 0.00 66.70 65.60 4xia h VAL 36 Cb 0.49 1.89 -0.04 0.00 -1.52 0.00 0.00 31.29 32.12 4xia h VAL 36 CO 0.02 0.60 0.38 -0.08 0.02 0.00 0.00 177.57 178.51 4xia h GLU 37 N 0.55 1.21 0.06 1.57 4.81 -1.83 -1.65 114.58 119.30 4xia h GLU 37 Ca -0.03 -0.19 -0.00 0.00 -0.13 0.00 0.00 59.36 59.00 4xia h GLU 37 Cb 1.32 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.49 4xia h GLU 37 CO 0.15 0.95 -0.03 0.00 -0.73 0.00 0.00 179.01 179.34 4xia h ALA 38 N 1.20 -0.08 -0.51 2.92 0.00 -1.22 0.22 119.26 121.78 4xia h ALA 38 Ca 0.28 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.20 4xia h ALA 38 Cb 0.15 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 4xia h ALA 38 CO -0.03 -0.55 0.31 0.28 0.00 0.00 0.00 179.25 179.27 4xia h VAL 39 N -0.08 1.07 -0.21 0.00 2.07 -0.99 -0.39 116.25 117.71 4xia h VAL 39 Ca -0.01 -0.22 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 4xia h VAL 39 Cb 0.06 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 4xia h VAL 39 CO 0.01 0.11 0.02 0.45 0.02 0.00 0.00 177.57 178.18 4xia h HIS 40 N 0.63 0.40 -0.49 1.57 -0.00 -0.88 -2.37 115.15 114.01 4xia h HIS 40 Ca 0.20 -0.06 -0.03 0.00 -0.00 0.00 0.00 60.37 60.48 4xia h HIS 40 Cb -0.00 -0.11 -0.02 0.00 -0.00 0.00 0.00 27.41 27.28 4xia h HIS 40 CO -0.06 0.53 0.18 -0.22 -0.00 0.00 0.00 177.93 178.36 4xia h LYS 41 N 0.15 0.74 -0.21 2.45 1.63 -0.44 -2.04 116.57 118.84 4xia h LYS 41 Ca 0.06 -0.14 0.01 0.00 -0.85 0.00 0.00 60.65 59.73 4xia h LYS 41 Cb 0.36 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.86 4xia h LYS 41 CO 0.01 0.68 0.11 -0.07 -3.45 0.00 0.00 179.45 176.73 4xia h LEU 42 N 0.65 0.18 -0.92 5.20 3.38 -1.07 -2.70 115.31 120.02 4xia h LEU 42 Ca 0.16 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.15 4xia h LEU 42 Cb 0.23 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.90 4xia h LEU 42 CO -0.01 0.13 0.61 0.00 0.09 0.00 0.00 178.44 179.26 4xia h ALA 43 N 1.10 1.17 -0.81 1.53 0.00 -1.31 -2.26 119.26 118.68 4xia h ALA 43 Ca 0.08 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 4xia h ALA 43 Cb 0.01 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 17.40 4xia h ALA 43 CO -0.05 0.54 0.36 0.93 0.00 0.00 0.00 179.25 181.03 4xia h GLU 44 N 1.22 1.19 0.00 0.00 5.08 -1.06 -2.51 114.58 118.50 4xia h GLU 44 Ca 0.34 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 4xia h GLU 44 Cb -0.11 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 28.94 4xia h GLU 44 CO -0.08 0.93 0.00 1.28 -1.00 0.00 0.00 179.01 180.14 4xia n LEU 45 N -4.31 0.44 0.00 1.33 4.77 -1.06 -4.90 117.00 113.28 4xia n LEU 45 Ca 0.08 0.60 0.00 0.00 -0.03 0.00 0.00 56.01 56.65 4xia n LEU 45 Cb 0.16 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.73 4xia n LEU 45 CO 0.40 -0.39 0.00 0.61 -1.33 0.00 0.00 177.39 176.68 4xia n GLY 46 N 0.23 1.09 3.78 -0.72 0.00 -0.95 -4.74 105.19 103.88 4xia n GLY 46 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 4xia n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4xia s ALA 47 N -2.00 2.50 -0.12 4.61 0.00 -0.87 -3.30 121.76 122.57 4xia s ALA 47 Ca 0.00 0.50 0.17 0.00 0.00 0.00 0.00 51.96 52.63 4xia s ALA 47 Cb 0.00 -3.30 -0.23 0.00 0.00 0.00 0.00 23.12 19.59 4xia s ALA 47 CO 0.00 -1.23 0.44 0.98 0.00 0.00 0.00 175.76 175.95 4xia n TYR 48 N -2.43 0.48 -3.85 0.00 4.19 0.35 -4.63 117.16 111.28 4xia n TYR 48 Ca 0.10 0.17 -0.07 0.00 3.31 0.00 0.00 57.90 61.41 4xia n TYR 48 Cb 0.52 -1.01 -0.01 0.00 0.49 0.00 0.00 39.34 39.32 4xia n TYR 48 CO 0.00 0.00 0.00 0.20 0.91 0.00 0.00 176.86 177.97 4xia s GLY 49 N -5.13 -0.05 0.04 2.98 0.00 -1.20 -2.22 107.32 101.75 4xia s GLY 49 Ca -0.07 -0.34 0.03 0.00 0.00 0.00 0.00 44.72 44.34 4xia s GLY 49 CO 0.83 -0.10 -0.09 -1.50 0.00 0.00 0.00 173.10 172.25 4xia s ILE 50 N -3.70 0.65 0.23 0.90 2.07 -0.57 -2.77 121.20 118.01 4xia s ILE 50 Ca 0.12 -0.97 0.07 0.00 -1.41 0.00 0.00 60.65 58.46 4xia s ILE 50 Cb -0.06 -0.67 -0.05 0.00 0.13 0.00 0.00 42.46 41.81 4xia s ILE 50 CO 0.07 -0.25 -0.11 0.42 -1.91 0.00 0.00 174.94 173.17 4xia s THR 51 N -1.12 1.67 0.13 4.00 -4.23 -0.43 -3.72 115.64 111.93 4xia s THR 51 Ca -0.06 -2.17 -0.24 0.00 -1.18 0.00 0.00 61.69 58.04 4xia s THR 51 Cb -0.09 -2.20 0.08 0.00 1.34 0.00 0.00 72.50 71.63 4xia s THR 51 CO 0.01 -0.48 0.65 0.72 -0.54 0.00 0.00 174.62 174.97 4xia s PHE 52 N -3.01 -0.51 0.10 3.99 -0.12 -1.25 -0.67 117.98 116.51 4xia s PHE 52 Ca 0.25 0.31 -0.13 0.00 -0.05 0.00 0.00 56.93 57.31 4xia s PHE 52 Cb 0.01 0.56 -0.06 0.00 -0.63 0.00 0.00 43.02 42.89 4xia s PHE 52 CO 0.09 -0.80 0.47 -1.01 -0.05 0.00 0.00 175.22 173.92 4xia s HIS 53 N -3.64 3.62 0.21 3.49 3.76 -1.26 -1.75 115.29 119.73 4xia s HIS 53 Ca 0.02 0.95 -0.21 0.00 -0.15 0.00 0.00 55.06 55.67 4xia s HIS 53 Cb -0.01 -2.28 0.15 0.00 1.11 0.00 0.00 32.58 31.55 4xia s HIS 53 CO -0.12 0.50 1.55 0.38 -0.85 0.00 0.00 174.74 176.20 4xia h ASP 54 N 3.80 -1.58 0.23 1.40 -0.00 -1.55 0.19 116.42 118.90 4xia h ASP 54 Ca -0.49 0.30 0.00 0.00 -0.00 0.00 0.00 57.03 56.84 4xia h ASP 54 Cb 1.20 0.78 0.00 0.00 -0.00 0.00 0.00 39.33 41.31 4xia h ASP 54 CO 0.65 -0.28 0.00 0.59 -0.00 0.00 0.00 179.24 180.20 4xia n ASN 55 N -5.42 0.00 -0.07 4.15 5.03 -1.25 -0.77 115.26 116.94 4xia n ASN 55 Ca 0.07 -0.25 -0.14 0.00 0.87 0.00 0.00 54.58 55.13 4xia n ASN 55 Cb 0.36 -0.17 -0.06 0.00 -1.02 0.00 0.00 39.78 38.89 4xia n ASN 55 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.26 175.87 4xia h ASP 56 N 0.00 0.73 0.00 6.41 3.45 -1.01 -3.38 116.42 122.62 4xia h ASP 56 Ca 0.00 -0.54 -0.27 0.00 0.43 0.00 0.00 57.03 56.65 4xia h ASP 56 Cb 0.11 -0.21 -0.04 0.00 -0.56 0.00 0.00 39.33 38.63 4xia h ASP 56 CO 0.00 1.13 -1.59 -0.11 -1.57 0.00 0.00 179.24 177.09 4xia n LEU 57 N -4.23 1.89 -4.40 1.55 7.94 -0.93 -4.91 117.00 113.91 4xia n LEU 57 Ca -0.06 0.41 -0.37 0.00 -1.11 0.00 0.00 56.01 54.89 4xia n LEU 57 Cb 0.54 -0.90 -0.12 0.00 0.53 0.00 0.00 43.42 43.47 4xia n LEU 57 CO 0.46 0.27 -0.27 -0.63 -1.11 0.00 0.00 177.39 176.11 4xia s ILE 58 N -2.43 4.19 0.58 1.96 1.01 0.05 -5.03 121.20 121.54 4xia s ILE 58 Ca -0.31 -0.39 -0.18 0.00 0.00 0.00 0.00 60.65 59.77 4xia s ILE 58 Cb 0.08 -3.05 -0.07 0.00 0.01 0.00 0.00 42.46 39.43 4xia s ILE 58 CO 0.51 0.22 0.69 -2.65 0.00 0.00 0.00 174.94 173.71 4xia n PRO 59 N 4.91 0.65 -0.24 2.79 -0.02 -1.26 -3.78 135.00 138.04 4xia n PRO 59 Ca -0.15 0.25 0.01 0.00 -2.02 0.00 0.00 63.50 61.59 4xia n PRO 59 Cb 0.50 -1.87 0.23 0.00 -0.02 0.00 0.00 33.50 32.34 4xia n PRO 59 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 4xia h PHE 60 N 0.33 0.99 0.00 6.00 3.57 -1.95 -2.63 116.94 123.26 4xia h PHE 60 Ca -0.47 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.06 4xia h PHE 60 Cb 1.39 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 39.79 4xia h PHE 60 CO 0.33 0.61 -0.60 -0.25 -2.23 0.00 0.00 178.31 176.18 4xia n ASP 61 N -4.42 0.71 -4.50 0.41 10.43 -1.26 -5.00 116.55 112.91 4xia n ASP 61 Ca 0.09 0.15 -0.46 0.00 2.57 0.00 0.00 54.79 57.13 4xia n ASP 61 Cb 0.05 0.11 -0.02 0.00 1.84 0.00 0.00 41.12 43.10 4xia n ASP 61 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 4xia n ALA 62 N -1.83 -1.51 -1.93 2.24 0.00 -0.99 -4.99 120.51 111.49 4xia n ALA 62 Ca 0.03 0.42 -0.29 0.00 0.00 0.00 0.00 53.44 53.60 4xia n ALA 62 Cb 0.44 -1.83 0.04 0.00 0.00 0.00 0.00 19.45 18.10 4xia n ALA 62 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 4xia s THR 63 N -0.98 3.54 0.26 0.00 -4.23 -1.26 -4.82 115.64 108.14 4xia s THR 63 Ca 0.62 0.38 -0.05 0.00 -1.18 0.00 0.00 61.69 61.46 4xia s THR 63 Cb -0.82 -3.48 0.26 0.00 1.34 0.00 0.00 72.50 69.80 4xia s THR 63 CO 0.58 -0.60 1.91 0.00 -0.54 0.00 0.00 174.62 175.97 4xia h ALA 64 N -0.54 1.32 0.12 3.99 0.00 -1.98 0.17 119.26 122.34 4xia h ALA 64 Ca -0.45 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.43 4xia h ALA 64 Cb 1.25 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 4xia h ALA 64 CO 0.63 0.56 -0.32 0.00 0.00 0.00 0.00 179.25 180.13 4xia h ALA 65 N 1.40 -0.54 -0.51 0.00 0.00 -1.99 0.39 119.26 118.01 4xia h ALA 65 Ca 0.40 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.27 4xia h ALA 65 Cb -0.02 0.52 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 4xia h ALA 65 CO -0.12 -0.86 0.32 0.93 0.00 0.00 0.00 179.25 179.51 4xia h GLU 66 N -0.54 0.62 0.32 0.00 5.08 -1.71 0.35 114.58 118.70 4xia h GLU 66 Ca 0.03 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 4xia h GLU 66 Cb 0.57 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.68 4xia h GLU 66 CO -0.19 0.41 -0.17 -0.09 -1.00 0.00 0.00 179.01 177.97 4xia h ARG 67 N 0.64 -0.44 -0.43 2.33 2.43 -0.33 -0.32 114.38 118.25 4xia h ARG 67 Ca 0.20 0.03 0.09 0.00 -0.81 0.00 0.00 59.98 59.49 4xia h ARG 67 Cb -0.02 0.10 -0.09 0.00 -0.42 0.00 0.00 29.97 29.55 4xia h ARG 67 CO -0.07 -0.29 -0.16 0.93 -1.51 0.00 0.00 179.97 178.86 4xia h GLU 68 N -0.45 -0.06 0.07 0.20 4.39 -0.60 -1.46 114.58 116.66 4xia h GLU 68 Ca -0.04 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.69 4xia h GLU 68 Cb 0.36 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.98 4xia h GLU 68 CO 0.06 -0.04 -0.39 -0.22 -1.16 0.00 0.00 179.01 177.26 4xia h LYS 69 N -0.07 -0.57 -0.13 2.33 3.11 -0.62 -1.78 116.57 118.84 4xia h LYS 69 Ca 0.21 0.04 0.04 0.00 -2.81 0.00 0.00 60.65 58.13 4xia h LYS 69 Cb 0.39 0.13 -0.04 0.00 -1.00 0.00 0.00 32.23 31.71 4xia h LYS 69 CO -0.48 -0.38 -0.11 0.82 -2.81 0.00 0.00 179.45 176.49 4xia h ILE 70 N -0.59 0.68 -0.28 2.00 2.04 -0.67 -2.92 117.51 117.77 4xia h ILE 70 Ca 0.04 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.90 4xia h ILE 70 Cb 0.64 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 4xia h ILE 70 CO -0.26 0.00 0.19 -0.07 0.00 0.00 0.00 178.15 178.01 4xia h LEU 71 N -0.13 0.32 -0.22 1.44 3.38 -1.10 -1.51 115.31 117.50 4xia h LEU 71 Ca 0.09 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 4xia h LEU 71 Cb 0.26 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 4xia h LEU 71 CO -0.21 0.23 -0.24 1.23 0.09 0.00 0.00 178.44 179.53 4xia h GLY 72 N 0.37 0.59 1.14 0.83 0.00 -1.14 0.13 103.07 105.00 4xia h GLY 72 Ca 0.10 -0.62 -0.13 0.00 0.00 0.00 0.00 47.33 46.68 4xia h GLY 72 CO -0.02 0.56 -0.22 -0.55 0.00 0.00 0.00 176.54 176.31 4xia h ASP 73 N 0.23 1.00 0.28 0.19 3.45 -1.36 -1.93 116.42 118.29 4xia h ASP 73 Ca 0.03 -0.38 -0.01 0.00 0.43 0.00 0.00 57.03 57.10 4xia h ASP 73 Cb 0.80 -0.28 0.00 0.00 -0.56 0.00 0.00 39.33 39.30 4xia h ASP 73 CO 0.06 1.17 -0.14 0.15 -1.57 0.00 0.00 179.24 178.92 4xia h PHE 74 N 0.84 -0.35 0.00 4.55 3.57 -1.24 -0.65 116.94 123.66 4xia h PHE 74 Ca 0.11 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 4xia h PHE 74 Cb 0.80 0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.65 4xia h PHE 74 CO 0.05 -0.10 -0.02 -0.91 -2.23 0.00 0.00 178.31 175.10 4xia h ASN 75 N -0.57 0.00 0.13 0.41 4.21 -0.68 -2.14 115.58 116.94 4xia h ASN 75 Ca -0.04 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.46 4xia h ASN 75 Cb 0.42 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.62 4xia h ASN 75 CO 0.06 0.02 -0.06 -0.61 -1.29 0.00 0.00 177.43 175.55 4xia h GLN 76 N 0.00 -0.17 -0.58 0.81 5.75 -1.22 -1.86 115.11 117.83 4xia h GLN 76 Ca -0.00 0.01 0.03 0.00 -0.15 0.00 0.00 58.65 58.54 4xia h GLN 76 Cb 0.05 0.04 -0.04 0.00 1.07 0.00 0.00 27.48 28.60 4xia h GLN 76 CO 0.00 0.14 0.35 0.00 -2.65 0.00 0.00 178.83 176.67 4xia h ALA 77 N 0.32 0.75 -0.55 3.38 0.00 -0.60 0.60 119.26 123.15 4xia h ALA 77 Ca -0.02 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.90 4xia h ALA 77 Cb 0.39 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 4xia h ALA 77 CO 0.03 0.07 0.34 -0.07 0.00 0.00 0.00 179.25 179.62 4xia h LEU 78 N 0.68 0.56 -0.10 0.00 3.38 -1.43 -1.51 115.31 116.90 4xia h LEU 78 Ca 0.24 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 4xia h LEU 78 Cb 0.04 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 4xia h LEU 78 CO -0.11 0.40 0.03 0.00 0.09 0.00 0.00 178.44 178.85 4xia h ALA 79 N 1.23 0.14 -0.98 1.53 0.00 -0.62 0.57 119.26 121.12 4xia h ALA 79 Ca 0.22 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 55.11 4xia h ALA 79 Cb -0.00 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 17.67 4xia h ALA 79 CO -0.08 -0.25 0.62 -0.44 0.00 0.00 0.00 179.25 179.09 4xia h ASP 80 N -0.02 0.93 0.08 0.00 3.45 0.88 -3.21 116.42 118.54 4xia h ASP 80 Ca 0.03 0.04 -0.26 0.00 0.43 0.00 0.00 57.03 57.27 4xia h ASP 80 Cb 0.22 -0.15 -0.05 0.00 -0.56 0.00 0.00 39.33 38.79 4xia h ASP 80 CO -0.00 0.53 -2.19 0.35 -1.57 0.00 0.00 179.24 176.37 4xia n THR 81 N -4.60 1.06 -0.47 0.35 -2.24 -0.63 -5.02 114.28 102.73 4xia n THR 81 Ca 0.17 -0.76 0.00 0.00 -2.27 0.00 0.00 64.05 61.19 4xia n THR 81 Cb 0.29 -0.40 0.00 0.00 -2.10 0.00 0.00 70.33 68.12 4xia n THR 81 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4xia n GLY 82 N 1.60 0.75 3.76 3.38 0.00 0.20 -5.03 105.19 109.84 4xia n GLY 82 Ca -0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 4xia n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4xia s LEU 83 N 0.00 4.47 0.67 0.99 1.43 -1.18 -4.97 118.68 120.09 4xia s LEU 83 Ca 0.00 2.53 -0.05 0.00 -1.03 0.00 0.00 54.13 55.59 4xia s LEU 83 Cb 0.00 -3.64 0.06 0.00 0.03 0.00 0.00 46.19 42.64 4xia s LEU 83 CO 0.00 -0.40 0.96 -0.54 0.23 0.00 0.00 176.35 176.59 4xia s LYS 84 N -1.57 2.23 -0.53 1.70 -0.14 -0.94 -4.81 119.74 115.69 4xia s LYS 84 Ca 0.48 -0.43 0.04 0.00 -1.36 0.00 0.00 55.97 54.69 4xia s LYS 84 Cb -0.37 -2.25 0.16 0.00 -1.68 0.00 0.00 37.83 33.69 4xia s LYS 84 CO 0.48 -1.14 0.37 0.08 -0.76 0.00 0.00 175.35 174.38 4xia s VAL 85 N -3.13 1.58 -0.22 3.17 1.01 -1.26 -1.52 120.40 120.03 4xia s VAL 85 Ca 0.60 -3.21 0.22 0.00 0.00 0.00 0.00 61.98 59.59 4xia s VAL 85 Cb -0.10 -2.07 0.25 0.00 0.00 0.00 0.00 36.38 34.46 4xia s VAL 85 CO 0.43 -1.05 1.62 -0.65 0.00 0.00 0.00 175.10 175.45 4xia h PRO 86 N 5.88 0.00 -3.43 2.72 0.11 -1.86 -3.00 132.00 132.42 4xia h PRO 86 Ca 0.14 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.09 4xia h PRO 86 Cb 0.86 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 31.74 4xia h PRO 86 CO 0.53 0.19 -0.49 1.41 -0.21 0.00 0.00 178.00 179.42 4xia s MET 87 N -3.23 0.39 0.03 1.05 -2.45 -1.26 -1.89 119.30 111.93 4xia s MET 87 Ca 0.05 -0.16 0.04 0.00 -1.25 0.00 0.00 55.69 54.36 4xia s MET 87 Cb 0.07 0.17 -0.02 0.00 1.25 0.00 0.00 34.83 36.30 4xia s MET 87 CO 0.68 -0.08 -0.11 0.08 1.05 0.00 0.00 175.02 176.63 4xia s VAL 88 N -0.85 0.86 0.18 10.11 1.01 -0.83 -3.86 120.40 127.02 4xia s VAL 88 Ca -0.09 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.06 4xia s VAL 88 Cb -0.05 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.50 4xia s VAL 88 CO 0.01 -0.01 0.12 0.28 0.00 0.00 0.00 175.10 175.49 4xia s THR 89 N -0.75 0.02 -0.05 3.92 -1.32 -0.72 -1.79 115.64 114.96 4xia s THR 89 Ca -0.00 -1.97 0.05 0.00 -1.21 0.00 0.00 61.69 58.56 4xia s THR 89 Cb -0.07 -2.39 -0.02 0.00 -1.51 0.00 0.00 72.50 68.52 4xia s THR 89 CO 0.01 -0.11 -0.20 -0.89 -2.21 0.00 0.00 174.62 171.22 4xia s THR 90 N -4.13 2.56 -0.45 5.08 2.01 -1.26 -1.35 115.64 118.10 4xia s THR 90 Ca 0.35 -0.90 -0.24 0.00 0.31 0.00 0.00 61.69 61.21 4xia s THR 90 Cb 0.07 -1.97 0.03 0.00 0.01 0.00 0.00 72.50 70.64 4xia s THR 90 CO 0.09 0.58 0.87 0.21 -0.69 0.00 0.00 174.62 175.68 4xia s ASN 91 N -0.46 6.47 -0.27 3.53 3.84 -1.26 -4.84 114.94 121.96 4xia s ASN 91 Ca 0.05 0.04 0.09 0.00 0.21 0.00 0.00 52.86 53.26 4xia s ASN 91 Cb -0.12 -2.42 0.45 0.00 -0.55 0.00 0.00 41.25 38.61 4xia s ASN 91 CO 0.01 -0.99 1.19 0.18 -2.79 0.00 0.00 177.10 174.71 4xia n LEU 92 N 6.97 4.22 0.00 3.21 4.77 -1.26 -4.76 117.00 130.15 4xia n LEU 92 Ca 0.05 -4.44 0.00 0.00 -0.03 0.00 0.00 56.01 51.59 4xia n LEU 92 Cb 0.48 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 4xia n LEU 92 CO 0.62 1.88 0.00 2.22 -1.33 0.00 0.00 177.39 180.78 4xia n PHE 93 N -0.78 0.00 0.11 -1.77 1.16 -1.26 -4.41 117.46 110.51 4xia n PHE 93 Ca 0.36 0.00 -0.24 0.00 -1.87 0.00 0.00 57.45 55.70 4xia n PHE 93 Cb 0.90 0.00 -0.15 0.00 -1.61 0.00 0.00 39.48 38.62 4xia n PHE 93 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 4xia h SER 94 N 0.00 0.72 -3.93 5.98 0.02 -1.93 -3.46 113.55 110.95 4xia h SER 94 Ca 0.00 -0.92 -0.53 0.00 -0.84 0.00 0.00 61.79 59.50 4xia h SER 94 Cb 0.00 -0.23 0.08 0.00 0.14 0.00 0.00 62.40 62.39 4xia h SER 94 CO 0.00 1.75 0.66 -2.28 -1.14 0.00 0.00 176.83 175.82 4xia s HIS 95 N -2.59 2.82 0.54 3.45 2.46 -1.26 -4.90 115.29 115.82 4xia s HIS 95 Ca -0.13 1.36 0.36 0.00 0.47 0.00 0.00 55.06 57.12 4xia s HIS 95 Cb 0.05 -3.75 1.54 0.00 -0.13 0.00 0.00 32.58 30.29 4xia s HIS 95 CO 0.89 -2.24 1.82 -1.35 -2.47 0.00 0.00 174.74 171.40 4xia h PRO 96 N 2.93 0.00 -0.48 2.88 0.11 -2.03 -1.36 132.00 134.05 4xia h PRO 96 Ca -0.50 -0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.68 4xia h PRO 96 Cb 1.24 -0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.32 4xia h PRO 96 CO 0.64 0.00 0.32 -0.24 -0.21 0.00 0.00 178.00 178.51 4xia h VAL 97 N 0.00 0.96 -0.27 3.15 3.04 -1.97 -2.17 116.25 118.99 4xia h VAL 97 Ca 0.54 -0.13 -0.01 0.00 -1.01 0.00 0.00 66.70 66.09 4xia h VAL 97 Cb 2.18 0.54 -0.01 0.00 -2.01 0.00 0.00 31.29 31.98 4xia h VAL 97 CO -0.01 0.07 0.02 0.49 -1.01 0.00 0.00 177.57 177.13 4xia n PHE 98 N -4.47 0.99 0.33 3.17 0.99 -0.51 -4.55 117.46 113.39 4xia n PHE 98 Ca 0.07 -0.37 0.21 0.00 -0.00 0.00 0.00 57.45 57.35 4xia n PHE 98 Cb 0.27 -0.31 1.12 0.00 -1.00 0.00 0.00 39.48 39.56 4xia n PHE 98 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.76 178.33 4xia h LYS 99 N 1.77 0.00 -0.04 -1.08 2.10 -1.55 -1.86 116.57 115.91 4xia h LYS 99 Ca 0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.66 4xia h LYS 99 Cb 1.22 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.55 4xia h LYS 99 CO 0.24 0.00 0.00 -3.47 -2.00 0.00 0.00 179.45 174.23 4xia n ASP 100 N -3.18 1.97 0.00 7.07 2.03 -1.26 -5.06 116.55 118.12 4xia n ASP 100 Ca -0.03 -1.86 0.00 0.00 0.52 0.00 0.00 54.79 53.43 4xia n ASP 100 Cb 0.10 -0.03 0.00 0.00 -0.72 0.00 0.00 41.12 40.48 4xia n ASP 100 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 4xia n GLY 101 N -0.29 2.18 0.00 0.27 0.00 -0.70 -3.67 105.19 102.98 4xia n GLY 101 Ca 0.01 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 43.91 4xia n GLY 101 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4xia n GLY 102 N -1.18 -0.03 0.43 -0.02 0.00 -1.26 -4.24 105.19 98.89 4xia n GLY 102 Ca 0.00 0.00 0.24 0.00 0.00 0.00 0.00 46.02 46.26 4xia n GLY 102 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 4xia h PHE 103 N 0.00 0.24 -0.20 1.61 0.04 -1.89 -2.58 116.94 114.17 4xia h PHE 103 Ca 0.00 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.78 4xia h PHE 103 Cb 0.00 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 38.08 4xia h PHE 103 CO 0.00 0.06 0.00 0.25 -0.60 0.00 0.00 178.31 178.02 4xia n THR 104 N -4.39 1.92 -1.63 -1.55 -2.24 -1.26 -4.46 114.28 100.66 4xia n THR 104 Ca 0.18 -1.76 -0.41 0.00 -2.27 0.00 0.00 64.05 59.79 4xia n THR 104 Cb 0.82 -0.08 0.01 0.00 -2.10 0.00 0.00 70.33 68.98 4xia n THR 104 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 4xia n SER 105 N -0.54 1.54 0.06 3.42 2.88 -0.97 -4.82 113.62 115.19 4xia n SER 105 Ca 0.17 1.03 -0.00 0.00 -1.33 0.00 0.00 58.87 58.74 4xia n SER 105 Cb 0.72 -1.39 0.29 0.00 -0.75 0.00 0.00 64.21 63.08 4xia n SER 105 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 4xia h ASN 106 N 1.59 0.35 -2.71 -3.46 2.35 -1.92 -3.42 115.58 108.36 4xia h ASN 106 Ca -0.46 -0.10 -0.56 0.00 -0.55 0.00 0.00 56.30 54.64 4xia h ASN 106 Cb 1.33 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 39.59 4xia h ASN 106 CO 0.57 0.56 1.07 -0.62 -1.65 0.00 0.00 177.43 177.35 4xia s ASP 107 N -6.83 6.63 0.30 5.81 2.15 -1.26 -4.95 116.67 118.52 4xia s ASP 107 Ca -0.06 1.95 -0.01 0.00 0.43 0.00 0.00 52.55 54.86 4xia s ASP 107 Cb 0.15 -2.53 0.45 0.00 -0.30 0.00 0.00 42.92 40.68 4xia s ASP 107 CO 0.76 -1.00 1.89 -0.09 -0.17 0.00 0.00 175.17 176.56 4xia h ARG 108 N 9.67 0.90 0.00 4.34 2.43 -2.00 -2.19 114.38 127.53 4xia h ARG 108 Ca -0.35 -0.13 -0.11 0.00 -0.81 0.00 0.00 59.98 58.58 4xia h ARG 108 Cb 1.16 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 30.53 4xia h ARG 108 CO 0.97 0.71 -0.53 0.66 -1.51 0.00 0.00 179.97 180.28 4xia h SER 109 N 0.89 0.00 -0.22 -3.80 4.64 -1.96 -2.00 113.55 111.11 4xia h SER 109 Ca 0.22 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.36 4xia h SER 109 Cb 0.13 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.21 4xia h SER 109 CO -0.03 0.53 -0.54 0.40 -0.87 0.00 0.00 176.83 176.32 4xia h ILE 110 N 0.00 1.28 -0.50 0.95 2.04 -1.86 -2.46 117.51 116.96 4xia h ILE 110 Ca -0.01 -1.74 0.03 0.00 1.00 0.00 0.00 64.86 64.14 4xia h ILE 110 Cb 0.95 1.65 -0.04 0.00 -0.74 0.00 0.00 36.82 38.65 4xia h ILE 110 CO 0.07 0.56 0.29 0.03 0.00 0.00 0.00 178.15 179.10 4xia h ARG 111 N 0.62 0.55 -0.73 2.37 3.08 -0.85 0.11 114.38 119.53 4xia h ARG 111 Ca 0.01 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 4xia h ARG 111 Cb 1.14 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 31.03 4xia h ARG 111 CO 0.12 0.36 0.37 0.00 -1.07 0.00 0.00 179.97 179.76 4xia h ARG 112 N 0.57 1.04 0.05 0.04 3.08 -1.35 -2.41 114.38 115.39 4xia h ARG 112 Ca 0.21 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 4xia h ARG 112 Cb 0.05 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 29.91 4xia h ARG 112 CO -0.11 0.80 -0.02 0.35 -1.07 0.00 0.00 179.97 179.91 4xia h PHE 113 N 1.02 -0.06 -0.54 3.04 3.04 -0.97 -1.48 116.94 120.98 4xia h PHE 113 Ca 0.25 -0.00 0.07 0.00 3.98 0.00 0.00 57.97 62.27 4xia h PHE 113 Cb 0.08 0.02 -0.06 0.00 2.56 0.00 0.00 35.95 38.55 4xia h PHE 113 CO 0.00 0.12 0.23 0.00 -2.02 0.00 0.00 178.31 176.64 4xia h ALA 114 N 0.71 0.69 -0.69 2.41 0.00 -0.67 -0.17 119.26 121.55 4xia h ALA 114 Ca -0.01 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 4xia h ALA 114 Cb 0.21 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 4xia h ALA 114 CO 0.01 -0.15 0.25 1.25 0.00 0.00 0.00 179.25 180.61 4xia h LEU 115 N 0.44 0.97 -0.65 0.00 5.85 -1.43 -1.68 115.31 118.82 4xia h LEU 115 Ca 0.25 -0.19 -0.12 0.00 0.84 0.00 0.00 57.88 58.66 4xia h LEU 115 Cb 0.24 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 4xia h LEU 115 CO -0.22 0.90 -0.27 0.00 -0.34 0.00 0.00 178.44 178.50 4xia h ALA 116 N 1.11 0.83 -0.49 1.25 0.00 -0.69 0.85 119.26 122.11 4xia h ALA 116 Ca 0.23 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.75 4xia h ALA 116 Cb 0.25 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 4xia h ALA 116 CO -0.01 0.64 0.32 -0.22 0.00 0.00 0.00 179.25 179.97 4xia h LYS 117 N 0.66 0.62 0.08 0.00 3.64 -0.86 -2.15 116.57 118.57 4xia h LYS 117 Ca 0.08 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 4xia h LYS 117 Cb 0.79 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 4xia h LYS 117 CO 0.07 0.41 -0.04 0.28 -2.27 0.00 0.00 179.45 177.90 4xia h VAL 118 N 0.64 1.01 -0.76 2.00 2.07 -0.78 -2.56 116.25 117.87 4xia h VAL 118 Ca 0.19 -0.32 0.02 0.00 0.82 0.00 0.00 66.70 67.41 4xia h VAL 118 Cb -0.04 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 4xia h VAL 118 CO -0.06 0.08 0.49 -0.07 0.02 0.00 0.00 177.57 178.04 4xia h LEU 119 N -0.25 0.83 -0.65 2.57 3.38 -0.71 -1.76 115.31 118.72 4xia h LEU 119 Ca -0.01 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 4xia h LEU 119 Cb 0.21 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 4xia h LEU 119 CO 0.02 0.59 0.18 0.45 0.09 0.00 0.00 178.44 179.77 4xia h HIS 120 N 0.98 1.07 -0.01 1.13 3.86 -1.38 -2.80 115.15 118.01 4xia h HIS 120 Ca 0.30 -0.12 -0.02 0.00 -1.16 0.00 0.00 60.37 59.37 4xia h HIS 120 Cb -0.04 -0.31 -0.00 0.00 1.06 0.00 0.00 27.41 28.12 4xia h HIS 120 CO -0.03 0.88 -0.09 -0.97 0.86 0.00 0.00 177.93 178.58 4xia h ASN 121 N 0.96 0.01 -0.56 2.45 -1.24 -0.99 -2.29 115.58 113.93 4xia h ASN 121 Ca 0.21 -0.00 -0.08 0.00 0.71 0.00 0.00 56.30 57.14 4xia h ASN 121 Cb 0.33 -0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.35 4xia h ASN 121 CO -0.00 0.11 0.03 0.40 -1.29 0.00 0.00 177.43 176.67 4xia h ILE 122 N 0.02 1.26 -0.23 2.57 2.04 -1.06 0.95 117.51 123.06 4xia h ILE 122 Ca 0.00 -1.07 -0.01 0.00 1.00 0.00 0.00 64.86 64.78 4xia h ILE 122 Cb 0.17 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 4xia h ILE 122 CO 0.01 0.38 0.09 0.44 0.00 0.00 0.00 178.15 179.08 4xia h ASP 123 N 0.85 0.31 -0.60 1.72 3.45 -1.35 -0.56 116.42 120.23 4xia h ASP 123 Ca 0.16 -0.16 -0.06 0.00 0.43 0.00 0.00 57.03 57.40 4xia h ASP 123 Cb 0.50 -0.08 -0.03 0.00 -0.56 0.00 0.00 39.33 39.16 4xia h ASP 123 CO 0.02 0.39 0.16 0.25 -1.57 0.00 0.00 179.24 178.49 4xia h LEU 124 N 0.22 0.94 -0.13 1.55 5.85 -1.19 -1.73 115.31 120.81 4xia h LEU 124 Ca 0.08 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.64 4xia h LEU 124 Cb 0.17 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 4xia h LEU 124 CO -0.01 0.90 -0.02 0.00 -0.34 0.00 0.00 178.44 178.98 4xia h ALA 125 N 1.21 0.10 -0.21 1.25 0.00 -0.28 -1.15 119.26 120.19 4xia h ALA 125 Ca 0.20 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 4xia h ALA 125 Cb 0.34 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 4xia h ALA 125 CO -0.00 -0.47 0.12 0.00 0.00 0.00 0.00 179.25 178.90 4xia h ALA 126 N 1.12 0.27 -0.59 0.00 0.00 -1.04 -2.33 119.26 116.70 4xia h ALA 126 Ca 0.06 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.97 4xia h ALA 126 Cb 0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 4xia h ALA 126 CO -0.12 -0.22 0.39 1.49 0.00 0.00 0.00 179.25 180.79 4xia h GLU 127 N 0.25 0.59 0.00 0.00 4.81 -0.90 -1.97 114.58 117.36 4xia h GLU 127 Ca 0.08 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 4xia h GLU 127 Cb 0.03 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.28 4xia h GLU 127 CO -0.01 0.39 -0.10 -1.33 -0.73 0.00 0.00 179.01 177.23 4xia n MET 128 N -4.47 0.16 -0.80 1.92 2.81 -0.47 -4.95 117.12 111.32 4xia n MET 128 Ca 0.08 0.11 0.00 0.00 -1.81 0.00 0.00 57.70 56.08 4xia n MET 128 Cb 0.20 -1.67 0.00 0.00 -0.71 0.00 0.00 33.22 31.04 4xia n MET 128 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 4xia n GLY 129 N 1.39 0.51 3.77 3.03 0.00 -0.74 -4.62 105.19 108.53 4xia n GLY 129 Ca 0.06 -0.81 -0.38 0.00 0.00 0.00 0.00 46.02 44.89 4xia n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4xia s ALA 130 N -2.00 3.00 -0.07 4.61 0.00 -0.90 -4.77 121.76 121.62 4xia s ALA 130 Ca 0.00 1.07 0.21 0.00 0.00 0.00 0.00 51.96 53.24 4xia s ALA 130 Cb 0.00 -3.44 -0.31 0.00 0.00 0.00 0.00 23.12 19.37 4xia s ALA 130 CO 0.00 -0.84 0.37 -0.85 0.00 0.00 0.00 175.76 174.44 4xia n GLU 131 N -0.47 0.67 -4.82 0.00 0.28 -0.79 -4.71 120.64 110.79 4xia n GLU 131 Ca 0.07 -0.15 -0.25 0.00 -0.16 0.00 0.00 57.16 56.67 4xia n GLU 131 Cb 0.47 -1.51 -0.16 0.00 1.43 0.00 0.00 31.44 31.66 4xia n GLU 131 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 4xia s THR 132 N -3.23 1.38 -0.26 3.84 2.01 -1.09 -1.76 115.64 116.53 4xia s THR 132 Ca -0.08 -0.71 0.02 0.00 0.31 0.00 0.00 61.69 61.22 4xia s THR 132 Cb 0.12 -1.17 0.05 0.00 0.01 0.00 0.00 72.50 71.51 4xia s THR 132 CO 0.88 0.40 -0.09 0.12 -0.69 0.00 0.00 174.62 175.23 4xia s PHE 133 N -0.14 3.23 0.06 4.92 5.36 0.15 -1.97 117.98 129.59 4xia s PHE 133 Ca 0.01 -2.16 -0.09 0.00 -0.96 0.00 0.00 56.93 53.73 4xia s PHE 133 Cb -0.09 -1.97 -0.05 0.00 -0.34 0.00 0.00 43.02 40.56 4xia s PHE 133 CO 0.01 -0.85 0.36 0.08 -1.46 0.00 0.00 175.22 173.35 4xia s VAL 134 N 1.15 5.16 -0.25 3.12 1.01 -0.74 -1.29 120.40 128.57 4xia s VAL 134 Ca -0.07 0.35 0.01 0.00 0.00 0.00 0.00 61.98 62.27 4xia s VAL 134 Cb -0.19 -3.62 0.06 0.00 0.00 0.00 0.00 36.38 32.63 4xia s VAL 134 CO -0.05 0.30 -0.05 -0.04 0.00 0.00 0.00 175.10 175.27 4xia s MET 135 N -1.89 1.68 -0.35 2.72 -1.94 -0.33 -4.23 119.30 114.95 4xia s MET 135 Ca 0.32 -1.12 -0.09 0.00 -1.71 0.00 0.00 55.69 53.09 4xia s MET 135 Cb -0.14 -2.66 0.03 0.00 2.01 0.00 0.00 34.83 34.07 4xia s MET 135 CO 0.18 -0.63 0.15 -0.46 -0.01 0.00 0.00 175.02 174.25 4xia s TRP 136 N 1.32 3.23 -1.40 -0.03 -0.00 -1.26 -1.30 118.94 119.50 4xia s TRP 136 Ca -0.05 -1.06 -0.10 0.00 -0.00 0.00 0.00 56.10 54.90 4xia s TRP 136 Cb -0.19 -2.36 0.08 0.00 -0.00 0.00 0.00 33.47 31.00 4xia s TRP 136 CO -0.07 -0.64 2.28 0.41 -0.00 0.00 0.00 176.95 178.93 4xia n GLY 137 N 4.92 4.69 0.27 5.86 0.00 -1.26 -4.74 105.19 114.93 4xia n GLY 137 Ca -0.13 -1.85 0.03 0.00 0.00 0.00 0.00 46.02 44.07 4xia n GLY 137 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 4xia h GLY 138 N 7.71 0.40 -1.69 -0.02 0.00 -1.91 -2.26 103.07 105.30 4xia h GLY 138 Ca 0.60 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.72 4xia h GLY 138 CO 1.69 0.19 0.00 0.54 0.00 0.00 0.00 176.54 178.96 4xia n ARG 139 N -4.36 2.37 -2.51 4.80 5.12 -1.26 -4.08 116.66 116.73 4xia n ARG 139 Ca 0.01 -2.06 -0.42 0.00 -1.93 0.00 0.00 57.85 53.45 4xia n ARG 139 Cb 0.19 -1.37 -0.03 0.00 -1.16 0.00 0.00 32.46 30.09 4xia n ARG 139 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 4xia s GLU 140 N -1.10 3.35 0.00 5.56 0.41 -0.85 -3.46 118.70 122.61 4xia s GLU 140 Ca 0.29 0.17 0.00 0.00 -0.41 0.00 0.00 54.97 55.02 4xia s GLU 140 Cb 0.16 -4.10 0.00 0.00 -1.78 0.00 0.00 34.13 28.41 4xia s GLU 140 CO 0.22 -1.91 0.00 0.41 -0.49 0.00 0.00 175.26 173.49 4xia n GLY 141 N 5.22 -0.55 3.65 -1.39 0.00 -1.26 -0.93 105.19 109.92 4xia n GLY 141 Ca 0.08 -0.73 -0.09 0.00 0.00 0.00 0.00 46.02 45.28 4xia n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 4xia s SER 142 N -4.00 -0.40 -0.20 1.61 1.04 -0.58 -4.99 113.70 106.18 4xia s SER 142 Ca 0.00 -0.32 0.16 0.00 0.48 0.00 0.00 55.95 56.27 4xia s SER 142 Cb 0.00 0.67 -0.24 0.00 0.10 0.00 0.00 66.02 66.54 4xia s SER 142 CO 0.00 -1.17 0.06 -0.62 0.98 0.00 0.00 173.24 172.49 4xia n GLU 143 N -0.42 0.69 -4.92 4.02 4.71 -1.26 -1.52 120.64 121.94 4xia n GLU 143 Ca -0.10 0.01 -0.30 0.00 -0.01 0.00 0.00 57.16 56.77 4xia n GLU 143 Cb 0.62 -1.53 -0.15 0.00 -1.01 0.00 0.00 31.44 29.37 4xia n GLU 143 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 4xia s TYR 144 N -2.50 2.24 0.30 -0.32 1.51 -1.26 -4.91 117.35 112.42 4xia s TYR 144 Ca -0.12 -0.41 0.20 0.00 -1.01 0.00 0.00 57.07 55.72 4xia s TYR 144 Cb 0.06 -1.36 0.92 0.00 -0.11 0.00 0.00 41.96 41.48 4xia s TYR 144 CO 0.81 0.10 1.86 -0.44 -1.11 0.00 0.00 175.55 176.77 4xia h ASP 145 N 4.90 0.00 -0.52 2.29 3.32 -1.98 -3.18 116.42 121.24 4xia h ASP 145 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 4xia h ASP 145 Cb 1.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.69 4xia h ASP 145 CO 0.44 0.29 0.00 0.61 -1.72 0.00 0.00 179.24 178.87 4xia n GLY 146 N -0.24 2.17 0.24 2.75 0.00 -1.26 -4.36 105.19 104.49 4xia n GLY 146 Ca -0.01 -0.68 0.12 0.00 0.00 0.00 0.00 46.02 45.45 4xia n GLY 146 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 4xia h SER 147 N 3.29 0.00 -4.97 1.61 0.02 -1.99 -3.45 113.55 108.06 4xia h SER 147 Ca 0.00 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.78 4xia h SER 147 Cb 1.20 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 63.57 4xia h SER 147 CO 0.18 0.16 -0.69 -0.54 -1.14 0.00 0.00 176.83 174.80 4xia s LYS 148 N -3.70 0.62 -0.35 3.45 -0.14 -1.26 -5.02 119.74 113.33 4xia s LYS 148 Ca 0.00 -1.11 -0.19 0.00 -1.36 0.00 0.00 55.97 53.31 4xia s LYS 148 Cb 0.10 0.02 -0.00 0.00 -1.68 0.00 0.00 37.83 36.27 4xia s LYS 148 CO 0.61 -0.06 0.58 0.34 -0.76 0.00 0.00 175.35 176.07 4xia s ASP 149 N -2.60 6.38 0.42 2.83 -1.08 -1.26 -4.95 116.67 116.42 4xia s ASP 149 Ca 0.03 0.08 0.11 0.00 -0.52 0.00 0.00 52.55 52.25 4xia s ASP 149 Cb 0.03 -2.30 0.91 0.00 -1.46 0.00 0.00 42.92 40.09 4xia s ASP 149 CO -0.06 -0.54 1.99 -0.07 0.52 0.00 0.00 175.17 177.01 4xia h LEU 150 N 9.25 0.21 -0.08 -1.34 3.38 -1.99 -1.92 115.31 122.82 4xia h LEU 150 Ca -0.27 -0.03 -0.14 0.00 0.09 0.00 0.00 57.88 57.53 4xia h LEU 150 Cb 1.12 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 41.82 4xia h LEU 150 CO 0.81 0.29 -0.50 0.00 0.09 0.00 0.00 178.44 179.12 4xia h ALA 151 N 1.74 0.16 -0.57 1.53 0.00 -2.00 -3.16 119.26 116.97 4xia h ALA 151 Ca 0.05 -0.51 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 4xia h ALA 151 Cb 0.22 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 4xia h ALA 151 CO 0.01 0.35 0.17 0.00 0.00 0.00 0.00 179.25 179.78 4xia h ALA 152 N 0.43 1.23 -0.67 0.00 0.00 -1.89 -1.17 119.26 117.19 4xia h ALA 152 Ca -0.04 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.72 4xia h ALA 152 Cb 1.16 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.67 4xia h ALA 152 CO 0.10 0.54 0.40 0.00 0.00 0.00 0.00 179.25 180.29 4xia h ALA 153 N 1.35 0.89 -0.36 0.00 0.00 -1.42 0.46 119.26 120.18 4xia h ALA 153 Ca 0.19 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.96 4xia h ALA 153 Cb 0.26 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 4xia h ALA 153 CO -0.01 0.11 -0.30 -0.07 0.00 0.00 0.00 179.25 178.98 4xia h LEU 154 N 0.75 0.89 -0.36 0.00 3.38 -1.42 0.75 115.31 119.30 4xia h LEU 154 Ca 0.29 -0.45 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 4xia h LEU 154 Cb 0.11 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 4xia h LEU 154 CO -0.15 1.16 0.21 0.44 0.09 0.00 0.00 178.44 180.19 4xia h ASP 155 N 0.64 0.45 -0.21 -0.43 3.45 -0.53 -0.95 116.42 118.84 4xia h ASP 155 Ca 0.06 -0.07 -0.08 0.00 0.43 0.00 0.00 57.03 57.37 4xia h ASP 155 Cb 0.88 -0.11 -0.02 0.00 -0.56 0.00 0.00 39.33 39.52 4xia h ASP 155 CO 0.08 0.39 -0.13 0.03 -1.57 0.00 0.00 179.24 178.04 4xia h ARG 156 N 0.47 0.61 -0.21 3.56 2.47 0.08 -0.94 114.38 120.40 4xia h ARG 156 Ca 0.13 -0.19 -0.01 0.00 -1.26 0.00 0.00 59.98 58.65 4xia h ARG 156 Cb 0.04 -0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 28.29 4xia h ARG 156 CO -0.02 0.72 0.08 1.98 0.56 0.00 0.00 179.97 183.29 4xia h MET 157 N 0.55 0.32 -0.91 0.04 4.05 -0.52 -2.48 114.93 115.98 4xia h MET 157 Ca 0.10 -0.06 -0.00 0.00 -0.28 0.00 0.00 59.70 59.45 4xia h MET 157 Cb 0.54 -0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 31.25 4xia h MET 157 CO 0.03 0.39 0.56 -0.09 0.23 0.00 0.00 176.91 178.03 4xia h ARG 158 N 0.18 1.23 -0.23 0.39 2.43 -0.96 -1.35 114.38 116.07 4xia h ARG 158 Ca 0.07 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 4xia h ARG 158 Cb 0.19 -0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 4xia h ARG 158 CO -0.00 0.85 0.15 1.49 -1.51 0.00 0.00 179.97 180.95 4xia h GLU 159 N 1.25 0.31 0.38 0.20 4.81 -1.07 0.63 114.58 121.09 4xia h GLU 159 Ca 0.33 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.52 4xia h GLU 159 Cb -0.07 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.25 4xia h GLU 159 CO -0.06 0.22 -0.18 0.78 -0.73 0.00 0.00 179.01 179.04 4xia h GLY 160 N 0.30 -0.53 1.38 1.92 0.00 -1.23 0.43 103.07 105.35 4xia h GLY 160 Ca 0.08 0.20 -0.10 0.00 0.00 0.00 0.00 47.33 47.51 4xia h GLY 160 CO -0.02 -0.19 -0.19 -2.08 0.00 0.00 0.00 176.54 174.06 4xia h VAL 161 N -0.53 1.27 -0.05 4.60 2.07 -1.03 -2.46 116.25 120.12 4xia h VAL 161 Ca -0.05 -1.27 -0.16 0.00 0.82 0.00 0.00 66.70 66.04 4xia h VAL 161 Cb 0.40 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 4xia h VAL 161 CO 0.09 0.42 -0.69 0.44 0.02 0.00 0.00 177.57 177.85 4xia h ASP 162 N 0.64 0.28 0.05 0.57 3.45 -0.84 -1.70 116.42 118.87 4xia h ASP 162 Ca 0.10 -0.18 -0.00 0.00 0.43 0.00 0.00 57.03 57.37 4xia h ASP 162 Cb 0.68 -0.08 0.00 0.00 -0.56 0.00 0.00 39.33 39.36 4xia h ASP 162 CO 0.05 0.88 -0.03 0.74 -1.57 0.00 0.00 179.24 179.32 4xia h THR 163 N 0.17 1.22 -0.99 0.35 2.02 -0.76 -1.34 112.91 113.57 4xia h THR 163 Ca -0.02 -0.96 0.12 0.00 0.77 0.00 0.00 66.41 66.32 4xia h THR 163 Cb 1.23 1.85 -0.08 0.00 -1.74 0.00 0.00 68.15 69.41 4xia h THR 163 CO 0.11 0.24 0.63 0.00 0.37 0.00 0.00 175.52 176.86 4xia h ALA 164 N 0.40 1.55 -0.30 6.16 0.00 -1.40 -1.89 119.26 123.77 4xia h ALA 164 Ca -0.01 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 4xia h ALA 164 Cb 0.45 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 4xia h ALA 164 CO 0.01 0.21 -0.20 0.00 0.00 0.00 0.00 179.25 179.27 4xia h ALA 165 N 1.54 0.43 -0.28 0.00 0.00 -1.25 -1.73 119.26 117.97 4xia h ALA 165 Ca 0.49 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 4xia h ALA 165 Cb 0.50 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 4xia h ALA 165 CO -0.26 0.38 -0.19 0.78 0.00 0.00 0.00 179.25 179.96 4xia h GLY 166 N 0.42 0.56 0.80 0.00 0.00 -0.90 -1.47 103.07 102.48 4xia h GLY 166 Ca 0.06 -0.42 -0.05 0.00 0.00 0.00 0.00 47.33 46.92 4xia h GLY 166 CO 0.05 0.39 -0.06 -1.82 0.00 0.00 0.00 176.54 175.10 4xia h TYR 167 N 0.46 0.45 -0.12 5.60 3.20 -1.30 0.48 116.97 125.75 4xia h TYR 167 Ca 0.08 -0.10 0.04 0.00 3.14 0.00 0.00 58.73 61.88 4xia h TYR 167 Cb 0.60 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.72 4xia h TYR 167 CO 0.02 0.66 -0.11 0.82 -1.64 0.00 0.00 178.16 177.91 4xia h ILE 168 N 0.11 0.69 0.03 1.81 2.04 -0.82 -0.96 117.51 120.40 4xia h ILE 168 Ca 0.05 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.93 4xia h ILE 168 Cb 0.52 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 4xia h ILE 168 CO 0.02 0.00 -0.12 0.11 0.00 0.00 0.00 178.15 178.16 4xia h LYS 169 N -0.13 -0.21 -0.92 2.37 1.57 -1.19 0.62 116.57 118.69 4xia h LYS 169 Ca 0.08 0.01 0.08 0.00 -1.87 0.00 0.00 60.65 58.96 4xia h LYS 169 Cb 0.25 0.05 -0.07 0.00 0.08 0.00 0.00 32.23 32.54 4xia h LYS 169 CO -0.20 -0.14 0.57 -0.44 -0.57 0.00 0.00 179.45 178.67 4xia h ASP 170 N -0.22 0.87 0.41 0.86 3.32 0.40 -2.15 116.42 119.91 4xia h ASP 170 Ca 0.03 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.11 4xia h ASP 170 Cb 0.26 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.66 4xia h ASP 170 CO -0.10 0.52 -0.28 0.29 -1.72 0.00 0.00 179.24 177.96 4xia n LYS 171 N -4.62 0.47 -3.42 3.56 4.76 -0.40 -4.95 118.16 113.56 4xia n LYS 171 Ca 0.15 -0.24 -0.19 0.00 -2.87 0.00 0.00 58.31 55.16 4xia n LYS 171 Cb 0.24 -1.50 0.08 0.00 -1.84 0.00 0.00 35.03 32.01 4xia n LYS 171 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 4xia n GLY 172 N 1.39 -0.37 3.83 0.72 0.00 0.12 -5.00 105.19 105.88 4xia n GLY 172 Ca 0.10 0.12 -0.33 0.00 0.00 0.00 0.00 46.02 45.92 4xia n GLY 172 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 4xia s TYR 173 N -3.31 3.34 -1.16 1.61 4.12 -0.65 -4.97 117.35 116.33 4xia s TYR 173 Ca 0.29 1.51 -0.11 0.00 0.02 0.00 0.00 57.07 58.78 4xia s TYR 173 Cb -0.13 -2.77 0.23 0.00 -1.52 0.00 0.00 41.96 37.77 4xia s TYR 173 CO 0.67 -0.10 1.30 0.09 0.02 0.00 0.00 175.55 177.53 4xia n ASN 174 N -0.70 5.44 -3.91 2.29 3.02 -1.26 -4.79 115.26 115.35 4xia n ASN 174 Ca 0.06 -3.04 -0.11 0.00 -0.03 0.00 0.00 54.58 51.46 4xia n ASN 174 Cb 0.54 -1.45 -0.12 0.00 -0.61 0.00 0.00 39.78 38.13 4xia n ASN 174 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 4xia s LEU 175 N -0.20 1.98 0.05 3.41 1.43 -1.26 -4.48 118.68 119.61 4xia s LEU 175 Ca 0.36 -0.19 0.08 0.00 -1.03 0.00 0.00 54.13 53.35 4xia s LEU 175 Cb -0.05 0.18 -0.03 0.00 0.03 0.00 0.00 46.19 46.32 4xia s LEU 175 CO -0.03 -0.17 -0.23 -0.13 0.23 0.00 0.00 176.35 176.01 4xia s ARG 176 N -0.75 1.56 -0.06 1.70 0.52 -0.72 -4.99 118.95 116.21 4xia s ARG 176 Ca -0.08 -1.03 -0.13 0.00 -0.52 0.00 0.00 55.73 53.97 4xia s ARG 176 Cb -0.05 -1.72 -0.05 0.00 0.52 0.00 0.00 34.95 33.65 4xia s ARG 176 CO -0.00 0.44 0.32 0.42 0.02 0.00 0.00 175.30 176.50 4xia s ILE 177 N -0.82 5.21 -0.16 1.52 1.01 -0.23 -0.67 121.20 127.05 4xia s ILE 177 Ca 0.10 0.63 0.01 0.00 0.00 0.00 0.00 60.65 61.39 4xia s ILE 177 Cb -0.09 -3.62 0.02 0.00 0.01 0.00 0.00 42.46 38.77 4xia s ILE 177 CO 0.02 0.54 -0.16 0.00 0.00 0.00 0.00 174.94 175.34 4xia s ALA 178 N -0.71 2.02 0.09 9.38 0.00 -0.41 -0.21 121.76 131.92 4xia s ALA 178 Ca 0.20 -1.01 -0.21 0.00 0.00 0.00 0.00 51.96 50.95 4xia s ALA 178 Cb -0.15 -1.09 -0.07 0.00 0.00 0.00 0.00 23.12 21.81 4xia s ALA 178 CO 0.09 -0.36 0.61 -0.51 0.00 0.00 0.00 175.76 175.59 4xia s LEU 179 N 1.40 4.54 -0.32 0.00 1.43 -0.42 -1.19 118.68 124.11 4xia s LEU 179 Ca 0.05 1.34 -0.01 0.00 -1.03 0.00 0.00 54.13 54.47 4xia s LEU 179 Cb -0.13 -2.97 0.07 0.00 0.03 0.00 0.00 46.19 43.18 4xia s LEU 179 CO -0.11 0.26 0.04 -0.70 0.23 0.00 0.00 176.35 176.06 4xia s GLU 180 N -1.10 2.25 0.43 1.70 2.12 -0.42 -0.53 118.70 123.15 4xia s GLU 180 Ca 0.30 -1.43 -0.23 0.00 0.36 0.00 0.00 54.97 53.97 4xia s GLU 180 Cb -0.20 -3.24 -0.08 0.00 0.26 0.00 0.00 34.13 30.87 4xia s GLU 180 CO 0.20 -0.73 1.09 -2.14 -0.54 0.00 0.00 175.26 173.15 4xia s PRO 181 N 1.19 3.96 -0.21 4.30 0.02 -1.26 -4.31 135.00 138.69 4xia s PRO 181 Ca -0.01 1.60 -0.13 0.00 0.02 0.00 0.00 61.00 62.48 4xia s PRO 181 Cb -0.20 -2.44 0.06 0.00 0.02 0.00 0.00 34.50 31.94 4xia s PRO 181 CO -0.03 -0.34 0.52 0.21 -0.33 0.00 0.00 177.00 177.03 4xia s LYS 182 N -2.65 0.53 0.17 5.54 2.20 -1.22 -4.70 119.74 119.60 4xia s LYS 182 Ca 0.61 0.92 -0.06 0.00 -0.36 0.00 0.00 55.97 57.08 4xia s LYS 182 Cb -0.24 0.08 0.03 0.00 -1.51 0.00 0.00 37.83 36.19 4xia s LYS 182 CO 0.30 -0.14 1.47 -1.00 -0.36 0.00 0.00 175.35 175.61 4xia h PRO 183 N 6.79 0.68 -2.69 4.03 0.14 -1.70 -3.37 132.00 135.89 4xia h PRO 183 Ca -0.33 -0.43 0.10 0.00 0.14 0.00 0.00 66.00 65.48 4xia h PRO 183 Cb 1.20 0.05 -0.04 0.00 0.14 0.00 0.00 31.00 32.35 4xia h PRO 183 CO 0.23 1.05 0.41 0.54 0.14 0.00 0.00 178.00 180.37 4xia s ASN 184 N -6.93 -0.10 -0.03 1.44 4.22 -1.26 -1.91 114.94 110.36 4xia s ASN 184 Ca -0.09 -0.70 -0.02 0.00 -2.14 0.00 0.00 52.86 49.91 4xia s ASN 184 Cb 0.11 0.63 0.01 0.00 1.28 0.00 0.00 41.25 43.28 4xia s ASN 184 CO 0.86 -1.22 0.04 1.21 -2.04 0.00 0.00 177.10 175.96 4xia n GLU 185 N -0.54 -1.34 0.03 3.55 0.00 -1.26 -4.85 120.64 116.23 4xia n GLU 185 Ca -0.05 1.36 0.13 0.00 0.00 0.00 0.00 57.16 58.59 4xia n GLU 185 Cb 0.60 -1.95 0.42 0.00 0.00 0.00 0.00 31.44 30.51 4xia n GLU 185 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 4xia n PRO 186 N 0.49 0.09 -2.64 5.31 -0.04 -1.26 -5.03 135.00 131.92 4xia n PRO 186 Ca -0.07 0.05 -0.32 0.00 -0.04 0.00 0.00 63.50 63.12 4xia n PRO 186 Cb 0.11 -1.59 -0.04 0.00 -0.04 0.00 0.00 33.50 31.95 4xia n PRO 186 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 4xia s ARG 187 N -3.04 3.94 0.23 0.54 1.81 -1.26 -4.98 118.95 116.19 4xia s ARG 187 Ca 0.11 0.82 -0.07 0.00 -1.72 0.00 0.00 55.73 54.87 4xia s ARG 187 Cb 0.17 -2.24 0.21 0.00 -0.45 0.00 0.00 34.95 32.63 4xia s ARG 187 CO 0.61 -0.14 1.84 0.78 -0.68 0.00 0.00 175.30 177.71 4xia h GLY 188 N 1.25 1.33 -6.67 -3.53 0.00 -1.87 -3.41 103.07 90.18 4xia h GLY 188 Ca -0.47 -0.63 -0.43 0.00 0.00 0.00 0.00 47.33 45.80 4xia h GLY 188 CO 0.62 0.60 -0.77 0.99 0.00 0.00 0.00 176.54 177.99 4xia s ASP 189 N -6.27 1.31 -0.06 0.19 1.11 -0.58 -4.69 116.67 107.68 4xia s ASP 189 Ca -0.13 -0.11 -0.04 0.00 0.18 0.00 0.00 52.55 52.45 4xia s ASP 189 Cb 0.17 -0.45 -0.04 0.00 1.07 0.00 0.00 42.92 43.66 4xia s ASP 189 CO 0.83 -0.13 0.12 -0.63 1.18 0.00 0.00 175.17 176.55 4xia s ILE 190 N 1.50 5.21 0.49 0.77 1.01 -0.80 -1.53 121.20 127.85 4xia s ILE 190 Ca -0.02 -0.06 -0.21 0.00 0.00 0.00 0.00 60.65 60.36 4xia s ILE 190 Cb -0.13 -3.33 -0.07 0.00 0.01 0.00 0.00 42.46 38.94 4xia s ILE 190 CO -0.03 0.49 1.12 -0.36 0.00 0.00 0.00 174.94 176.16 4xia s PHE 191 N -1.12 2.84 -1.07 3.97 2.99 -0.11 -3.58 117.98 121.91 4xia s PHE 191 Ca 0.20 1.55 -0.09 0.00 0.00 0.00 0.00 56.93 58.59 4xia s PHE 191 Cb -0.12 -3.28 -0.06 0.00 0.00 0.00 0.00 43.02 39.56 4xia s PHE 191 CO 0.10 -1.37 0.90 1.28 -0.00 0.00 0.00 175.22 176.13 4xia n LEU 192 N -0.84 -5.16 0.22 -0.37 4.77 -1.26 -4.78 117.00 109.57 4xia n LEU 192 Ca 0.09 -0.76 0.08 0.00 -0.03 0.00 0.00 56.01 55.39 4xia n LEU 192 Cb 0.50 -3.07 0.48 0.00 -2.33 0.00 0.00 43.42 38.99 4xia n LEU 192 CO 0.44 0.17 0.80 1.55 -1.33 0.00 0.00 177.39 179.01 4xia h PRO 193 N -1.22 0.00 -4.89 3.23 0.13 -1.72 -3.23 132.00 124.31 4xia h PRO 193 Ca -0.62 0.00 -0.42 0.00 -0.87 0.00 0.00 66.00 64.09 4xia h PRO 193 Cb 1.32 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.31 4xia h PRO 193 CO 0.45 0.27 -0.55 0.95 -0.23 0.00 0.00 178.00 178.88 4xia s THR 194 N -3.85 0.32 0.18 1.56 -4.23 -1.26 -2.28 115.64 106.08 4xia s THR 194 Ca -0.01 -2.00 -0.15 0.00 -1.18 0.00 0.00 61.69 58.35 4xia s THR 194 Cb 0.12 -2.51 0.14 0.00 1.34 0.00 0.00 72.50 71.59 4xia s THR 194 CO 0.65 0.00 1.66 0.58 -0.54 0.00 0.00 174.62 176.97 4xia h VAL 195 N 2.20 0.55 -0.42 2.29 2.07 -1.92 -1.67 116.25 119.34 4xia h VAL 195 Ca -0.33 -0.01 0.06 0.00 0.82 0.00 0.00 66.70 67.24 4xia h VAL 195 Cb 1.25 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 31.47 4xia h VAL 195 CO 0.51 0.01 0.11 1.23 0.02 0.00 0.00 177.57 179.45 4xia h GLY 196 N 0.04 0.51 1.00 2.17 0.00 -1.96 -1.68 103.07 103.16 4xia h GLY 196 Ca 0.24 -0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.52 4xia h GLY 196 CO -0.47 -0.02 0.38 0.45 0.00 0.00 0.00 176.54 176.88 4xia h HIS 197 N 0.25 0.83 -0.35 5.60 -0.00 -1.82 -0.72 115.15 118.94 4xia h HIS 197 Ca 0.20 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.58 4xia h HIS 197 Cb 0.23 -0.27 -0.02 0.00 -0.00 0.00 0.00 27.41 27.35 4xia h HIS 197 CO -0.19 0.56 0.23 0.78 -0.00 0.00 0.00 177.93 179.31 4xia h GLY 198 N 0.86 0.49 0.98 2.45 0.00 -1.00 -1.81 103.07 105.03 4xia h GLY 198 Ca 0.23 -0.18 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 4xia h GLY 198 CO -0.04 0.17 0.28 1.41 0.00 0.00 0.00 176.54 178.36 4xia h LEU 199 N 0.46 0.60 0.12 3.11 3.38 -1.05 -2.47 115.31 119.47 4xia h LEU 199 Ca 0.13 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 4xia h LEU 199 Cb -0.05 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.55 4xia h LEU 199 CO -0.03 0.50 -0.06 0.00 0.09 0.00 0.00 178.44 178.94 4xia h ALA 200 N 1.13 -0.16 -0.53 1.53 0.00 -1.06 -3.14 119.26 117.03 4xia h ALA 200 Ca 0.17 -0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.10 4xia h ALA 200 Cb 0.02 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.79 4xia h ALA 200 CO -0.03 -0.54 0.10 0.35 0.00 0.00 0.00 179.25 179.12 4xia h PHE 201 N -0.26 0.15 -0.76 0.00 3.57 -1.27 -2.40 116.94 115.98 4xia h PHE 201 Ca -0.02 0.03 0.14 0.00 3.53 0.00 0.00 57.97 61.66 4xia h PHE 201 Cb 0.21 0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.91 4xia h PHE 201 CO -0.04 -0.03 0.51 0.82 -2.23 0.00 0.00 178.31 177.34 4xia h ILE 202 N 0.23 0.81 0.00 1.41 2.04 -1.39 -2.76 117.51 117.84 4xia h ILE 202 Ca 0.27 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.97 4xia h ILE 202 Cb 0.38 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 4xia h ILE 202 CO -0.36 0.08 0.00 -0.62 0.00 0.00 0.00 178.15 177.25 4xia n GLU 203 N -4.49 0.45 0.00 2.37 -0.58 -0.90 -2.50 120.64 114.99 4xia n GLU 203 Ca 0.14 0.05 0.06 0.00 -0.42 0.00 0.00 57.16 56.99 4xia n GLU 203 Cb 0.51 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.88 4xia n GLU 203 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 4xia n GLN 204 N -1.11 1.94 -2.57 3.49 1.13 -1.04 -5.00 117.38 114.22 4xia n GLN 204 Ca 0.12 -0.67 -0.31 0.00 -1.94 0.00 0.00 57.00 54.20 4xia n GLN 204 Cb 0.09 -1.13 -0.03 0.00 0.11 0.00 0.00 30.24 29.29 4xia n GLN 204 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 4xia s LEU 205 N -1.67 3.69 -0.01 1.08 1.43 -1.04 -4.99 118.68 117.17 4xia s LEU 205 Ca 0.09 1.35 -0.16 0.00 -1.03 0.00 0.00 54.13 54.39 4xia s LEU 205 Cb 0.09 -4.27 -0.34 0.00 0.03 0.00 0.00 46.19 41.70 4xia s LEU 205 CO 0.28 -0.53 0.88 -0.08 0.23 0.00 0.00 176.35 177.13 4xia h GLU 206 N 0.96 0.46 -1.11 1.70 4.81 -1.93 -3.33 114.58 116.13 4xia h GLU 206 Ca -0.47 -0.78 -0.68 0.00 -0.13 0.00 0.00 59.36 57.30 4xia h GLU 206 Cb 1.19 0.29 -0.30 0.00 0.63 0.00 0.00 28.75 30.56 4xia h GLU 206 CO 0.62 1.38 0.72 0.72 -0.73 0.00 0.00 179.01 181.72 4xia n HIS 207 N -3.77 3.16 0.01 0.92 8.25 -1.26 -4.81 115.22 117.73 4xia n HIS 207 Ca -0.19 -2.88 0.22 0.00 -0.26 0.00 0.00 57.72 54.61 4xia n HIS 207 Cb 1.05 -1.30 0.73 0.00 1.12 0.00 0.00 29.99 31.58 4xia n HIS 207 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 4xia h GLY 208 N 2.15 0.00 1.27 -1.41 0.00 -1.80 -3.06 103.07 100.21 4xia h GLY 208 Ca 0.58 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.96 4xia h GLY 208 CO 1.49 0.00 0.37 1.29 0.00 0.00 0.00 176.54 179.69 4xia h ASP 209 N 0.00 0.49 -0.41 0.19 3.04 -1.91 -1.71 116.42 116.12 4xia h ASP 209 Ca 0.25 -0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.04 4xia h ASP 209 Cb 1.15 -0.11 0.00 0.00 -1.04 0.00 0.00 39.33 39.33 4xia h ASP 209 CO -0.00 0.33 0.00 2.30 -2.04 0.00 0.00 179.24 179.83 4xia n ILE 210 N -4.47 2.19 -5.07 4.15 -5.35 -1.15 -4.97 119.36 104.69 4xia n ILE 210 Ca 0.07 -1.55 -0.32 0.00 -0.27 0.00 0.00 62.75 60.68 4xia n ILE 210 Cb 0.20 -0.11 -0.17 0.00 -1.74 0.00 0.00 39.64 37.83 4xia n ILE 210 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 4xia s VAL 211 N -2.45 2.11 0.00 7.28 1.01 -0.64 -1.07 120.40 126.64 4xia s VAL 211 Ca 0.45 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 61.43 4xia s VAL 211 Cb 0.33 -1.81 0.00 0.00 0.00 0.00 0.00 36.38 34.90 4xia s VAL 211 CO 0.14 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.40 4xia n GLY 212 N 3.66 4.99 3.58 4.51 0.00 0.71 -4.96 105.19 117.67 4xia n GLY 212 Ca -0.19 -1.35 -0.25 0.00 0.00 0.00 0.00 46.02 44.23 4xia n GLY 212 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4xia s LEU 213 N 0.00 2.83 -0.45 0.99 1.43 0.43 -1.31 118.68 122.61 4xia s LEU 213 Ca 0.00 -1.11 0.06 0.00 -1.03 0.00 0.00 54.13 52.05 4xia s LEU 213 Cb 0.00 -1.14 0.21 0.00 0.03 0.00 0.00 46.19 45.29 4xia s LEU 213 CO 0.00 -0.21 0.46 -3.20 0.23 0.00 0.00 176.35 173.63 4xia n ASN 214 N -0.86 0.45 -4.76 2.29 5.15 0.31 -2.48 115.26 115.37 4xia n ASN 214 Ca -0.05 -2.67 -0.36 0.00 -0.60 0.00 0.00 54.58 50.91 4xia n ASN 214 Cb 0.63 -0.62 0.02 0.00 -0.53 0.00 0.00 39.78 39.29 4xia n ASN 214 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 4xia s PRO 215 N -0.79 3.16 -0.08 1.20 0.02 -1.26 -4.38 135.00 132.88 4xia s PRO 215 Ca 0.34 1.82 0.02 0.00 0.02 0.00 0.00 61.00 63.20 4xia s PRO 215 Cb 0.09 -2.03 0.01 0.00 0.02 0.00 0.00 34.50 32.59 4xia s PRO 215 CO -0.15 -1.05 -0.13 -2.00 -0.33 0.00 0.00 177.00 173.34 4xia s GLU 216 N -3.20 1.88 0.12 5.54 2.12 -1.26 -1.42 118.70 122.48 4xia s GLU 216 Ca 0.74 -0.47 -0.25 0.00 0.36 0.00 0.00 54.97 55.35 4xia s GLU 216 Cb -0.30 -1.55 -0.06 0.00 0.26 0.00 0.00 34.13 32.48 4xia s GLU 216 CO 0.33 0.02 1.43 1.15 -0.54 0.00 0.00 175.26 177.66 4xia h THR 217 N 5.95 0.00 -0.26 -1.70 2.02 -1.78 -1.74 112.91 115.41 4xia h THR 217 Ca -0.30 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.88 4xia h THR 217 Cb 1.19 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 4xia h THR 217 CO 0.47 0.00 0.15 1.23 0.37 0.00 0.00 175.52 177.75 4xia h GLY 218 N -0.09 0.37 0.64 2.16 0.00 -1.87 -2.93 103.07 101.35 4xia h GLY 218 Ca 0.11 -0.15 -0.02 0.00 0.00 0.00 0.00 47.33 47.27 4xia h GLY 218 CO -0.68 0.14 -0.04 0.45 0.00 0.00 0.00 176.54 176.41 4xia h HIS 219 N 0.36 0.18 -0.18 5.60 3.86 -1.67 -1.46 115.15 121.84 4xia h HIS 219 Ca 0.09 -0.05 -0.08 0.00 -1.16 0.00 0.00 60.37 59.18 4xia h HIS 219 Cb -0.01 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 4xia h HIS 219 CO 0.00 0.55 -0.24 0.93 0.86 0.00 0.00 177.93 180.03 4xia h GLU 220 N -0.25 0.33 0.00 2.45 4.39 -1.38 -2.64 114.58 117.48 4xia h GLU 220 Ca 0.01 -0.11 -0.01 0.00 0.34 0.00 0.00 59.36 59.60 4xia h GLU 220 Cb 0.51 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.13 4xia h GLU 220 CO 0.01 0.55 -0.03 1.96 -1.16 0.00 0.00 179.01 180.35 4xia h GLN 221 N 0.30 0.00 0.00 2.33 4.20 -1.41 -2.06 115.11 118.46 4xia h GLN 221 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 4xia h GLN 221 Cb 0.59 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.37 4xia h GLN 221 CO 0.04 0.03 0.00 0.52 -0.67 0.00 0.00 178.83 178.75 4xia h MET 222 N 0.00 0.00 -0.30 1.46 2.86 -0.88 -2.40 114.93 115.67 4xia h MET 222 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 4xia h MET 222 Cb 0.43 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.09 4xia h MET 222 CO 0.00 0.00 0.00 0.00 1.06 0.00 0.00 176.91 177.97 4xia n ALA 223 N -2.04 2.40 -1.79 6.32 0.00 -0.82 -4.76 120.51 119.81 4xia n ALA 223 Ca 0.01 -0.93 -0.10 0.00 0.00 0.00 0.00 53.44 52.42 4xia n ALA 223 Cb 0.30 -0.73 -0.02 0.00 0.00 0.00 0.00 19.45 19.01 4xia n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 4xia n GLY 224 N 1.22 0.48 3.91 0.00 0.00 -0.90 -5.01 105.19 104.88 4xia n GLY 224 Ca 0.16 -0.53 -0.27 0.00 0.00 0.00 0.00 46.02 45.38 4xia n GLY 224 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4xia s LEU 225 N -2.53 3.46 -0.41 0.99 1.43 -0.92 -4.98 118.68 115.72 4xia s LEU 225 Ca 0.00 0.87 -0.22 0.00 -1.03 0.00 0.00 54.13 53.75 4xia s LEU 225 Cb 0.00 -3.79 0.02 0.00 0.03 0.00 0.00 46.19 42.45 4xia s LEU 225 CO 0.00 -0.77 0.71 0.21 0.23 0.00 0.00 176.35 176.73 4xia s ASN 226 N -4.18 6.41 0.30 2.29 3.84 -1.26 -4.22 114.94 118.12 4xia s ASN 226 Ca 0.50 -0.03 -0.02 0.00 0.21 0.00 0.00 52.86 53.52 4xia s ASN 226 Cb -0.10 -2.36 0.45 0.00 -0.55 0.00 0.00 41.25 38.69 4xia s ASN 226 CO 0.45 -0.77 1.95 0.15 -2.79 0.00 0.00 177.10 176.09 4xia h PHE 227 N 8.75 0.99 -0.49 0.43 3.04 -1.92 -1.49 116.94 126.25 4xia h PHE 227 Ca -0.25 0.00 -0.10 0.00 3.98 0.00 0.00 57.97 61.60 4xia h PHE 227 Cb 1.10 -0.33 -0.02 0.00 2.56 0.00 0.00 35.95 39.26 4xia h PHE 227 CO 0.77 0.66 -0.09 1.15 -2.02 0.00 0.00 178.31 178.78 4xia h THR 228 N 1.04 1.27 -0.56 4.41 2.02 -1.93 -0.91 112.91 118.25 4xia h THR 228 Ca 0.27 -1.21 -0.02 0.00 0.77 0.00 0.00 66.41 66.22 4xia h THR 228 Cb -0.05 1.05 -0.03 0.00 -1.74 0.00 0.00 68.15 67.38 4xia h THR 228 CO -0.05 0.42 0.29 0.45 0.37 0.00 0.00 175.52 177.00 4xia h HIS 229 N 0.78 0.79 0.10 3.16 3.86 -1.85 -0.48 115.15 121.51 4xia h HIS 229 Ca 0.13 -0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.30 4xia h HIS 229 Cb 0.63 -0.25 0.00 0.00 1.06 0.00 0.00 27.41 28.86 4xia h HIS 229 CO 0.05 0.60 -0.05 0.78 0.86 0.00 0.00 177.93 180.17 4xia h GLY 230 N 0.76 -0.13 1.81 2.45 0.00 -1.06 -2.58 103.07 104.31 4xia h GLY 230 Ca 0.20 0.05 -0.10 0.00 0.00 0.00 0.00 47.33 47.48 4xia h GLY 230 CO -0.03 -0.05 -0.38 0.16 0.00 0.00 0.00 176.54 176.25 4xia h ILE 231 N -0.24 1.29 -0.34 2.60 3.07 -1.20 -2.03 117.51 120.65 4xia h ILE 231 Ca -0.01 -1.43 0.06 0.00 1.55 0.00 0.00 64.86 65.03 4xia h ILE 231 Cb 0.20 1.64 -0.05 0.00 -0.27 0.00 0.00 36.82 38.34 4xia h ILE 231 CO 0.02 0.42 0.04 0.00 -1.05 0.00 0.00 178.15 177.58 4xia h ALA 232 N 1.43 0.34 -0.80 0.16 0.00 -1.01 0.98 119.26 120.36 4xia h ALA 232 Ca 0.02 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 4xia h ALA 232 Cb 0.76 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 4xia h ALA 232 CO 0.06 -0.37 0.34 0.37 0.00 0.00 0.00 179.25 179.65 4xia h GLN 233 N 0.14 1.17 -0.32 0.00 4.15 -1.13 0.90 115.11 120.02 4xia h GLN 233 Ca 0.17 -0.20 -0.04 0.00 0.77 0.00 0.00 58.65 59.35 4xia h GLN 233 Cb 0.21 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.69 4xia h GLN 233 CO -0.25 0.93 0.04 0.00 -1.93 0.00 0.00 178.83 177.62 4xia h ALA 234 N 1.22 0.43 -0.57 3.38 0.00 -0.79 -2.59 119.26 120.34 4xia h ALA 234 Ca 0.27 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 4xia h ALA 234 Cb 0.18 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 4xia h ALA 234 CO -0.03 0.14 0.22 1.25 0.00 0.00 0.00 179.25 180.83 4xia h LEU 235 N 0.36 0.79 -0.95 0.00 6.46 -0.49 -0.08 115.31 121.40 4xia h LEU 235 Ca 0.10 -0.18 0.11 0.00 -0.12 0.00 0.00 57.88 57.79 4xia h LEU 235 Cb 0.37 -0.21 -0.08 0.00 -0.73 0.00 0.00 40.66 40.01 4xia h LEU 235 CO 0.01 0.75 0.58 -0.25 -0.62 0.00 0.00 178.44 178.91 4xia h TRP 236 N 0.78 1.05 0.00 1.25 7.01 -0.79 -0.16 115.95 125.08 4xia h TRP 236 Ca 0.19 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.22 4xia h TRP 236 Cb 0.22 -0.33 0.00 0.00 -2.10 0.00 0.00 29.16 26.95 4xia h TRP 236 CO 0.01 0.41 -0.26 0.00 -2.79 0.00 0.00 178.44 175.81 4xia n ALA 237 N -2.36 2.86 -3.33 2.65 0.00 -0.98 -4.95 120.51 114.39 4xia n ALA 237 Ca 0.17 -0.20 -0.16 0.00 0.00 0.00 0.00 53.44 53.25 4xia n ALA 237 Cb 0.34 -1.30 0.08 0.00 0.00 0.00 0.00 19.45 18.57 4xia n ALA 237 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 4xia n GLU 238 N -1.64 -5.43 0.00 0.00 1.02 -0.07 -4.93 120.64 109.59 4xia n GLU 238 Ca 0.06 0.82 0.00 0.00 -0.02 0.00 0.00 57.16 58.02 4xia n GLU 238 Cb 0.36 -5.73 0.00 0.00 -0.02 0.00 0.00 31.44 26.05 4xia n GLU 238 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 4xia n LYS 239 N -3.82 2.01 -2.73 3.49 4.76 -0.16 -4.92 118.16 116.80 4xia n LYS 239 Ca -0.23 -1.18 -0.43 0.00 -2.87 0.00 0.00 58.31 53.60 4xia n LYS 239 Cb 0.65 -0.88 -0.02 0.00 -1.84 0.00 0.00 35.03 32.95 4xia n LYS 239 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 4xia s LEU 240 N -0.69 4.24 0.14 -0.35 2.96 -1.22 -0.43 118.68 123.33 4xia s LEU 240 Ca 0.00 -2.06 0.20 0.00 -0.22 0.00 0.00 54.13 52.05 4xia s LEU 240 Cb 0.00 -2.50 -0.07 0.00 0.50 0.00 0.00 46.19 44.13 4xia s LEU 240 CO 0.00 -1.20 0.94 0.49 -1.32 0.00 0.00 176.35 175.26 4xia n PHE 241 N 7.63 0.97 -3.89 5.38 3.01 -1.03 -4.92 117.46 124.61 4xia n PHE 241 Ca 0.34 0.30 -0.08 0.00 1.01 0.00 0.00 57.45 59.03 4xia n PHE 241 Cb 0.48 -1.02 -0.03 0.00 -0.01 0.00 0.00 39.48 38.90 4xia n PHE 241 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 4xia s HIS 242 N -3.16 -0.06 -0.04 1.38 2.46 -1.06 -4.87 115.29 109.93 4xia s HIS 242 Ca -0.02 -0.37 -0.10 0.00 0.47 0.00 0.00 55.06 55.05 4xia s HIS 242 Cb 0.09 0.58 0.02 0.00 -0.13 0.00 0.00 32.58 33.14 4xia s HIS 242 CO 0.80 -1.17 0.22 -1.50 -2.47 0.00 0.00 174.74 170.62 4xia s ILE 243 N -3.94 0.04 -0.21 0.89 2.07 -1.26 -4.09 121.20 114.70 4xia s ILE 243 Ca 0.14 -0.33 -0.02 0.00 -1.41 0.00 0.00 60.65 59.02 4xia s ILE 243 Cb -0.05 -0.43 0.00 0.00 0.13 0.00 0.00 42.46 42.11 4xia s ILE 243 CO 0.07 -0.18 -0.09 -1.81 -1.91 0.00 0.00 174.94 171.02 4xia s ASP 244 N -0.70 3.97 -0.16 4.50 1.01 -0.51 -3.49 116.67 121.30 4xia s ASP 244 Ca -0.08 -0.50 -0.05 0.00 0.71 0.00 0.00 52.55 52.63 4xia s ASP 244 Cb -0.04 -1.66 -0.03 0.00 1.01 0.00 0.00 42.92 42.19 4xia s ASP 244 CO 0.02 -0.02 -0.00 -0.76 0.21 0.00 0.00 175.17 174.61 4xia s LEU 245 N 1.41 3.47 0.00 1.23 1.43 0.33 -2.36 118.68 124.19 4xia s LEU 245 Ca 0.05 -0.03 0.00 0.00 -1.03 0.00 0.00 54.13 53.12 4xia s LEU 245 Cb -0.14 -1.85 0.00 0.00 0.03 0.00 0.00 46.19 44.23 4xia s LEU 245 CO -0.06 0.19 0.00 -0.46 0.23 0.00 0.00 176.35 176.25 4xia n ASN 246 N 3.39 0.00 -4.28 2.29 0.23 -1.26 -2.64 115.26 112.99 4xia n ASN 246 Ca -0.17 -0.90 -0.23 0.00 -0.53 0.00 0.00 54.58 52.75 4xia n ASN 246 Cb 0.52 0.00 -0.12 0.00 -2.08 0.00 0.00 39.78 38.10 4xia n ASN 246 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 4xia s GLY 247 N -1.56 1.21 -0.08 4.83 0.00 -0.32 -4.40 107.32 107.00 4xia s GLY 247 Ca 0.00 -1.25 -0.04 0.00 0.00 0.00 0.00 44.72 43.42 4xia s GLY 247 CO 0.00 -1.27 0.19 1.62 0.00 0.00 0.00 173.10 173.64 4xia s GLN 248 N -2.07 0.15 -1.07 2.90 2.00 -1.26 -1.31 119.66 119.01 4xia s GLN 248 Ca 0.07 0.43 -0.06 0.00 -2.00 0.00 0.00 55.36 53.81 4xia s GLN 248 Cb -0.09 -0.13 0.29 0.00 0.80 0.00 0.00 33.01 33.87 4xia s GLN 248 CO 0.04 -0.15 1.24 0.54 -0.50 0.00 0.00 175.29 176.46 4xia n ARG 249 N 4.13 3.85 0.00 1.67 1.74 -1.26 -3.42 116.66 123.36 4xia n ARG 249 Ca -0.25 -4.51 0.00 0.00 -0.77 0.00 0.00 57.85 52.32 4xia n ARG 249 Cb 0.53 -2.51 0.00 0.00 -1.02 0.00 0.00 32.46 29.46 4xia n ARG 249 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 4xia n GLY 250 N 1.98 0.26 3.58 -0.13 0.00 -1.26 -4.86 105.19 104.76 4xia n GLY 250 Ca 0.25 -1.96 -0.43 0.00 0.00 0.00 0.00 46.02 43.88 4xia n GLY 250 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 4xia s ILE 251 N -1.36 4.40 0.00 -0.61 1.01 -1.26 -4.61 121.20 118.77 4xia s ILE 251 Ca 0.00 0.94 0.00 0.00 0.00 0.00 0.00 60.65 61.59 4xia s ILE 251 Cb 0.00 -4.48 0.00 0.00 0.01 0.00 0.00 42.46 37.99 4xia s ILE 251 CO 0.00 -0.86 0.00 2.29 0.00 0.00 0.00 174.94 176.37 4xia n LYS 252 N 7.34 0.00 -1.30 2.79 2.85 -1.26 -5.10 118.16 123.48 4xia n LYS 252 Ca 0.08 0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 56.98 4xia n LYS 252 Cb 0.49 0.00 0.08 0.00 -0.65 0.00 0.00 35.03 34.95 4xia n LYS 252 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 177.40 179.83 4xia n TYR 253 N 0.00 0.08 -2.11 5.58 0.18 -1.26 -4.86 117.16 114.78 4xia n TYR 253 Ca 0.00 0.38 -0.43 0.00 1.88 0.00 0.00 57.90 59.73 4xia n TYR 253 Cb 0.00 -2.01 -0.03 0.00 -0.38 0.00 0.00 39.34 36.92 4xia n TYR 253 CO 0.00 0.00 0.00 0.16 -2.08 0.00 0.00 176.86 174.94 4xia s ASP 254 N -1.59 6.57 0.00 9.48 -4.77 -1.26 -4.88 116.67 120.22 4xia s ASP 254 Ca 0.70 1.88 -0.07 0.00 -3.30 0.00 0.00 52.55 51.76 4xia s ASP 254 Cb -0.34 -2.53 -0.30 0.00 -1.09 0.00 0.00 42.92 38.65 4xia s ASP 254 CO 0.54 -1.06 0.87 1.56 0.70 0.00 0.00 175.17 177.77 4xia h GLN 255 N 9.94 0.34 -5.79 2.11 4.20 -1.89 -3.49 115.11 120.52 4xia h GLN 255 Ca -0.35 -0.57 -0.36 0.00 0.06 0.00 0.00 58.65 57.43 4xia h GLN 255 Cb 1.16 0.21 0.13 0.00 0.30 0.00 0.00 27.48 29.28 4xia h GLN 255 CO 0.98 1.23 -0.79 -0.25 -0.67 0.00 0.00 178.83 179.33 4xia n ASP 256 N -3.54 -1.92 -4.25 1.46 8.00 -1.20 -4.71 116.55 110.39 4xia n ASP 256 Ca -0.18 -0.68 -0.30 0.00 0.71 0.00 0.00 54.79 54.35 4xia n ASP 256 Cb 1.06 -4.80 0.17 0.00 -0.02 0.00 0.00 41.12 37.54 4xia n ASP 256 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 4xia s LEU 257 N -6.49 2.60 0.56 0.64 1.43 -0.42 -0.61 118.68 116.39 4xia s LEU 257 Ca 0.02 0.37 -0.20 0.00 -1.03 0.00 0.00 54.13 53.29 4xia s LEU 257 Cb -0.01 -2.47 -0.04 0.00 0.03 0.00 0.00 46.19 43.69 4xia s LEU 257 CO 0.76 -2.65 1.25 -0.69 0.23 0.00 0.00 176.35 175.24 4xia s VAL 258 N -3.80 2.51 0.11 -1.59 1.01 -1.26 -1.17 120.40 116.21 4xia s VAL 258 Ca 0.72 0.35 -0.33 0.00 0.00 0.00 0.00 61.98 62.72 4xia s VAL 258 Cb -0.05 -3.16 -0.12 0.00 0.00 0.00 0.00 36.38 33.04 4xia s VAL 258 CO 0.52 -0.04 1.72 0.33 0.00 0.00 0.00 175.10 177.64 4xia n PHE 259 N -1.24 2.44 0.00 5.22 7.35 -1.26 -0.84 117.46 129.12 4xia n PHE 259 Ca 0.12 0.07 0.00 0.00 -0.76 0.00 0.00 57.45 56.88 4xia n PHE 259 Cb 0.48 -2.63 0.00 0.00 0.35 0.00 0.00 39.48 37.67 4xia n PHE 259 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 4xia n GLY 260 N 3.89 0.93 0.96 7.13 0.00 -1.26 -4.77 105.19 112.08 4xia n GLY 260 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 4xia n GLY 260 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 4xia n HIS 261 N -2.00 0.47 0.00 1.61 8.25 -0.02 -4.54 115.22 118.98 4xia n HIS 261 Ca 0.00 -0.24 0.00 0.00 -0.26 0.00 0.00 57.72 57.22 4xia n HIS 261 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 4xia n HIS 261 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 4xia n GLY 262 N 1.38 1.04 3.55 -1.41 0.00 -1.26 -4.81 105.19 103.69 4xia n GLY 262 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 4xia n GLY 262 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 4xia s ASP 263 N -0.22 6.16 0.07 1.61 3.68 -1.22 -4.89 116.67 121.85 4xia s ASP 263 Ca 0.00 -0.72 -0.25 0.00 2.13 0.00 0.00 52.55 53.71 4xia s ASP 263 Cb 0.00 -2.56 -0.16 0.00 -1.45 0.00 0.00 42.92 38.75 4xia s ASP 263 CO 0.00 -1.82 1.64 0.25 0.13 0.00 0.00 175.17 175.37 4xia h LEU 264 N 13.43 -0.11 -0.66 -1.34 5.85 -1.94 -0.83 115.31 129.71 4xia h LEU 264 Ca -0.11 -0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.58 4xia h LEU 264 Cb 1.04 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.06 4xia h LEU 264 CO 1.32 -0.00 0.39 0.74 -0.34 0.00 0.00 178.44 180.55 4xia h THR 265 N -0.21 1.04 -0.72 1.05 2.02 -1.96 0.11 112.91 114.24 4xia h THR 265 Ca -0.01 -0.26 -0.04 0.00 0.77 0.00 0.00 66.41 66.87 4xia h THR 265 Cb 0.17 0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 66.77 4xia h THR 265 CO 0.02 0.14 0.30 -1.28 0.37 0.00 0.00 175.52 175.07 4xia h SER 266 N 0.75 0.96 -0.57 4.18 0.87 -1.93 -2.43 113.55 115.38 4xia h SER 266 Ca 0.28 -0.13 0.03 0.00 -1.23 0.00 0.00 61.79 60.74 4xia h SER 266 Cb 0.09 -0.25 -0.04 0.00 -0.44 0.00 0.00 62.40 61.76 4xia h SER 266 CO -0.14 0.84 0.33 0.00 -0.53 0.00 0.00 176.83 177.34 4xia h ALA 267 N 1.30 0.74 -0.20 6.23 0.00 -0.00 -1.38 119.26 125.94 4xia h ALA 267 Ca 0.24 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.20 4xia h ALA 267 Cb 0.17 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.75 4xia h ALA 267 CO -0.02 0.04 -0.20 0.35 0.00 0.00 0.00 179.25 179.41 4xia h PHE 268 N 0.65 -0.53 0.00 0.00 3.57 -0.36 -1.18 116.94 119.09 4xia h PHE 268 Ca 0.24 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.72 4xia h PHE 268 Cb 0.06 0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 4xia h PHE 268 CO -0.07 -0.28 -0.21 0.74 -2.23 0.00 0.00 178.31 176.26 4xia h PHE 269 N -0.22 0.00 -0.07 0.41 -1.00 -1.30 -0.96 116.94 113.80 4xia h PHE 269 Ca 0.12 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.88 4xia h PHE 269 Cb 0.41 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.97 4xia h PHE 269 CO -0.35 0.21 -0.04 1.15 -1.61 0.00 0.00 178.31 177.67 4xia h THR 270 N 0.00 1.35 -0.50 -1.55 2.02 -0.82 -1.93 112.91 111.47 4xia h THR 270 Ca -0.00 -1.12 0.00 0.00 0.77 0.00 0.00 66.41 66.07 4xia h THR 270 Cb 0.61 1.95 -0.02 0.00 -1.74 0.00 0.00 68.15 68.95 4xia h THR 270 CO 0.03 0.31 0.33 0.58 0.37 0.00 0.00 175.52 177.13 4xia h VAL 271 N -0.26 1.13 -0.33 3.16 2.07 -0.90 0.68 116.25 121.81 4xia h VAL 271 Ca 0.01 -0.24 0.06 0.00 0.82 0.00 0.00 66.70 67.35 4xia h VAL 271 Cb 0.51 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 30.64 4xia h VAL 271 CO 0.01 0.13 0.01 -0.78 0.02 0.00 0.00 177.57 176.96 4xia h ASP 272 N 0.67 -0.11 -0.46 0.57 1.82 -1.16 0.81 116.42 118.56 4xia h ASP 272 Ca 0.18 0.07 -0.07 0.00 -0.39 0.00 0.00 57.03 56.82 4xia h ASP 272 Cb -0.07 0.13 -0.02 0.00 0.68 0.00 0.00 39.33 40.05 4xia h ASP 272 CO -0.04 -0.02 0.01 0.25 -1.61 0.00 0.00 179.24 177.84 4xia h LEU 273 N 0.11 0.79 -0.26 2.28 6.46 -0.87 0.30 115.31 124.11 4xia h LEU 273 Ca 0.16 -0.30 -0.07 0.00 -0.12 0.00 0.00 57.88 57.55 4xia h LEU 273 Cb 0.21 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 39.93 4xia h LEU 273 CO -0.26 0.89 -0.10 -0.07 -0.62 0.00 0.00 178.44 178.28 4xia h LEU 274 N 0.66 0.55 0.04 2.25 3.38 -0.38 -1.22 115.31 120.59 4xia h LEU 274 Ca 0.13 -0.39 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 4xia h LEU 274 Cb 0.48 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.08 4xia h LEU 274 CO 0.02 0.82 -0.02 -0.33 0.09 0.00 0.00 178.44 179.02 4xia h GLU 275 N 0.27 -0.06 0.00 1.13 4.39 -0.87 -3.41 114.58 116.04 4xia h GLU 275 Ca 0.06 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.63 4xia h GLU 275 Cb 0.60 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.24 4xia h GLU 275 CO 0.03 0.50 -1.43 0.09 -1.16 0.00 0.00 179.01 177.05 4xia n ASN 276 N -4.75 0.76 0.00 1.42 3.02 1.00 -5.07 115.26 111.64 4xia n ASN 276 Ca -0.07 0.32 0.00 0.00 -0.03 0.00 0.00 54.58 54.81 4xia n ASN 276 Cb 0.29 0.38 0.00 0.00 -0.61 0.00 0.00 39.78 39.84 4xia n ASN 276 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 4xia n GLY 277 N 1.36 -0.15 3.68 7.41 0.00 -0.46 -4.83 105.19 112.21 4xia n GLY 277 Ca -0.09 -1.14 -0.35 0.00 0.00 0.00 0.00 46.02 44.45 4xia n GLY 277 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 4xia s PHE 278 N 0.00 3.20 0.38 1.61 0.40 -1.26 -4.43 117.98 117.89 4xia s PHE 278 Ca 0.00 0.17 0.17 0.00 -0.60 0.00 0.00 56.93 56.67 4xia s PHE 278 Cb 0.00 -1.85 1.07 0.00 0.51 0.00 0.00 43.02 42.75 4xia s PHE 278 CO 0.00 0.42 1.75 -1.35 0.70 0.00 0.00 175.22 176.74 4xia h PRO 279 N 5.45 0.41 -0.11 0.24 0.11 -1.97 0.31 132.00 136.43 4xia h PRO 279 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 4xia h PRO 279 Cb 1.19 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.21 4xia h PRO 279 CO 0.57 0.27 0.00 0.09 -0.21 0.00 0.00 178.00 178.72 4xia n ASN 280 N -4.69 2.99 0.00 -2.05 3.02 -1.26 -5.03 115.26 108.23 4xia n ASN 280 Ca 0.26 -1.96 0.00 0.00 -0.03 0.00 0.00 54.58 52.85 4xia n ASN 280 Cb 0.88 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.99 4xia n ASN 280 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 4xia n GLY 281 N 1.37 1.11 0.00 7.41 0.00 0.11 -5.11 105.19 110.08 4xia n GLY 281 Ca 0.15 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.46 4xia n GLY 281 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4xia n GLY 282 N 1.16 -0.01 3.71 -0.02 0.00 -1.26 -4.80 105.19 103.97 4xia n GLY 282 Ca 0.00 -1.19 -0.31 0.00 0.00 0.00 0.00 46.02 44.52 4xia n GLY 282 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 4xia s PRO 283 N -2.00 1.57 -0.02 1.61 0.02 -1.26 -4.90 135.00 130.02 4xia s PRO 283 Ca 0.00 1.42 -0.03 0.00 0.02 0.00 0.00 61.00 62.41 4xia s PRO 283 Cb 0.00 -1.80 0.00 0.00 0.02 0.00 0.00 34.50 32.72 4xia s PRO 283 CO 0.00 -2.20 0.07 0.15 -0.33 0.00 0.00 177.00 174.69 4xia s LYS 284 N -4.69 0.18 -0.18 5.54 1.02 -1.26 -4.48 119.74 115.86 4xia s LYS 284 Ca 0.65 -0.07 -0.17 0.00 0.02 0.00 0.00 55.97 56.40 4xia s LYS 284 Cb -0.21 0.07 -0.04 0.00 -0.52 0.00 0.00 37.83 37.14 4xia s LYS 284 CO 0.56 -0.03 0.44 -0.47 -0.92 0.00 0.00 175.35 174.93 4xia s TYR 285 N -0.38 3.42 0.00 3.18 5.04 -1.26 -4.96 117.35 122.38 4xia s TYR 285 Ca -0.04 0.72 0.00 0.00 -2.44 0.00 0.00 57.07 55.31 4xia s TYR 285 Cb -0.03 -2.55 0.00 0.00 0.35 0.00 0.00 41.96 39.73 4xia s TYR 285 CO 0.00 0.03 0.96 -2.37 -1.34 0.00 0.00 175.55 172.84 4xia n THR 286 N 4.16 0.93 -0.83 4.34 5.66 -1.26 -4.90 114.28 122.37 4xia n THR 286 Ca -0.07 -0.93 -0.00 0.00 -3.05 0.00 0.00 64.05 59.99 4xia n THR 286 Cb 0.51 0.54 0.00 0.00 -1.55 0.00 0.00 70.33 69.83 4xia n THR 286 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 4xia n GLY 287 N -0.46 -1.61 3.81 1.09 0.00 -1.26 -5.03 105.19 101.71 4xia n GLY 287 Ca 0.00 -1.59 -0.33 0.00 0.00 0.00 0.00 46.02 44.10 4xia n GLY 287 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 4xia s PRO 288 N -3.04 3.40 -0.68 1.61 0.04 -1.26 -4.99 135.00 130.08 4xia s PRO 288 Ca 0.01 1.19 -0.11 0.00 0.04 0.00 0.00 61.00 62.13 4xia s PRO 288 Cb -0.00 -2.05 0.18 0.00 0.04 0.00 0.00 34.50 32.67 4xia s PRO 288 CO 0.01 -0.74 0.58 1.03 0.04 0.00 0.00 177.00 177.92 4xia s ARG 289 N -4.04 3.09 -0.12 4.56 3.00 -0.22 -4.34 118.95 120.89 4xia s ARG 289 Ca 0.63 -2.25 -0.13 0.00 0.00 0.00 0.00 55.73 53.98 4xia s ARG 289 Cb -0.15 -4.17 -0.05 0.00 0.00 0.00 0.00 34.95 30.58 4xia s ARG 289 CO 0.36 -1.25 0.30 -1.58 0.00 0.00 0.00 175.30 173.12 4xia s HIS 290 N 0.53 3.54 -0.37 -0.53 2.46 -1.23 -1.80 115.29 117.89 4xia s HIS 290 Ca 0.13 0.68 -0.13 0.00 0.47 0.00 0.00 55.06 56.21 4xia s HIS 290 Cb -0.18 -2.28 0.01 0.00 -0.13 0.00 0.00 32.58 30.00 4xia s HIS 290 CO -0.05 0.40 0.25 -0.06 -2.47 0.00 0.00 174.74 172.82 4xia s PHE 291 N -0.09 3.23 -0.70 3.88 0.40 -0.79 -0.52 117.98 123.40 4xia s PHE 291 Ca 0.18 -0.50 -0.00 0.00 -0.60 0.00 0.00 56.93 56.00 4xia s PHE 291 Cb -0.14 -2.51 0.17 0.00 0.51 0.00 0.00 43.02 41.06 4xia s PHE 291 CO 0.06 -0.51 0.51 0.34 0.70 0.00 0.00 175.22 176.33 4xia s ASP 292 N 1.67 5.24 0.29 1.36 3.68 -1.08 -3.68 116.67 124.15 4xia s ASP 292 Ca 0.05 -3.27 0.04 0.00 2.13 0.00 0.00 52.55 51.50 4xia s ASP 292 Cb -0.18 -1.80 -0.03 0.00 -1.45 0.00 0.00 42.92 39.45 4xia s ASP 292 CO 0.09 -0.25 0.20 -0.72 0.13 0.00 0.00 175.17 174.62 4xia s TYR 293 N -0.66 1.57 -0.04 -5.34 -0.85 -1.26 -4.58 117.35 106.19 4xia s TYR 293 Ca 0.21 -1.50 0.00 0.00 -0.52 0.00 0.00 57.07 55.26 4xia s TYR 293 Cb -0.15 -0.74 0.03 0.00 0.38 0.00 0.00 41.96 41.48 4xia s TYR 293 CO -0.07 -0.69 0.00 0.15 -1.52 0.00 0.00 175.55 173.42 4xia s LYS 294 N -3.74 0.37 0.05 -3.49 1.02 0.23 -4.34 119.74 109.83 4xia s LYS 294 Ca 0.38 0.09 -0.30 0.00 0.02 0.00 0.00 55.97 56.15 4xia s LYS 294 Cb 0.04 -0.59 -0.08 0.00 -0.52 0.00 0.00 37.83 36.69 4xia s LYS 294 CO 0.20 -0.17 1.63 -2.14 -0.92 0.00 0.00 175.35 173.96 4xia s PRO 295 N 1.23 4.20 0.15 -1.68 0.02 -1.26 -4.66 135.00 133.01 4xia s PRO 295 Ca -0.07 2.28 -0.34 0.00 0.02 0.00 0.00 61.00 62.90 4xia s PRO 295 Cb -0.13 -3.65 -0.16 0.00 0.02 0.00 0.00 34.50 30.57 4xia s PRO 295 CO -0.02 -0.74 1.14 0.43 -0.33 0.00 0.00 177.00 177.49 4xia n SER 296 N 5.80 1.15 0.31 2.53 7.64 -1.26 -4.88 113.62 124.91 4xia n SER 296 Ca 0.16 1.14 0.21 0.00 1.01 0.00 0.00 58.87 61.38 4xia n SER 296 Cb 0.41 -1.18 1.05 0.00 -1.01 0.00 0.00 64.21 63.48 4xia n SER 296 CO 0.00 0.00 0.00 0.08 -3.01 0.00 0.00 175.04 172.11 4xia h ARG 297 N 3.35 0.00 0.00 1.43 0.11 -1.91 -2.25 114.38 115.12 4xia h ARG 297 Ca -0.44 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.64 4xia h ARG 297 Cb 1.35 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.43 4xia h ARG 297 CO 0.70 0.00 0.00 1.79 0.10 0.00 0.00 179.97 182.56 4xia h THR 298 N 0.00 0.00 -3.18 0.08 1.35 -1.98 -3.46 112.91 105.72 4xia h THR 298 Ca 0.00 -0.37 -0.65 0.00 -0.55 0.00 0.00 66.41 64.84 4xia h THR 298 Cb 0.11 1.23 -0.10 0.00 -1.73 0.00 0.00 68.15 67.66 4xia h THR 298 CO 0.00 0.00 -0.60 -1.81 -0.25 0.00 0.00 175.52 172.86 4xia s ASP 299 N -4.84 5.53 0.64 5.36 1.11 -0.85 -5.13 116.67 118.48 4xia s ASP 299 Ca 0.04 0.03 0.00 0.00 0.18 0.00 0.00 52.55 52.80 4xia s ASP 299 Cb 0.09 -1.51 0.00 0.00 1.07 0.00 0.00 42.92 42.57 4xia s ASP 299 CO 0.47 0.21 0.00 0.61 1.18 0.00 0.00 175.17 177.64 4xia n GLY 300 N 0.76 -0.14 0.28 0.21 0.00 -1.26 -4.82 105.19 100.21 4xia n GLY 300 Ca -0.10 -1.81 0.14 0.00 0.00 0.00 0.00 46.02 44.24 4xia n GLY 300 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 4xia h TYR 301 N -0.64 0.00 -0.75 1.61 -1.99 -1.99 -1.91 116.97 111.30 4xia h TYR 301 Ca 0.00 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.69 4xia h TYR 301 Cb 0.00 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 38.70 4xia h TYR 301 CO 0.00 0.07 0.31 -0.44 -0.00 0.00 0.00 178.16 178.10 4xia h ASP 302 N 0.00 1.03 -0.63 3.88 3.45 -2.00 -2.04 116.42 120.11 4xia h ASP 302 Ca -0.00 -0.17 -0.07 0.00 0.43 0.00 0.00 57.03 57.22 4xia h ASP 302 Cb 0.20 -0.27 -0.03 0.00 -0.56 0.00 0.00 39.33 38.68 4xia h ASP 302 CO 0.01 0.92 0.13 1.23 -1.57 0.00 0.00 179.24 179.96 4xia h GLY 303 N 1.08 1.10 0.70 2.75 0.00 -1.72 0.16 103.07 107.15 4xia h GLY 303 Ca 0.25 -0.71 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 4xia h GLY 303 CO -0.02 0.66 -0.36 -2.08 0.00 0.00 0.00 176.54 174.74 4xia h VAL 304 N 0.94 0.27 -0.05 4.60 2.07 -0.74 0.32 116.25 123.65 4xia h VAL 304 Ca 0.19 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.60 4xia h VAL 304 Cb 0.39 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 4xia h VAL 304 CO 0.01 0.00 -0.51 -0.50 0.02 0.00 0.00 177.57 176.59 4xia h TRP 305 N -0.79 0.16 -0.28 1.57 4.06 -1.39 -2.13 115.95 117.16 4xia h TRP 305 Ca -0.04 -0.05 0.02 0.00 2.06 0.00 0.00 58.89 60.88 4xia h TRP 305 Cb 0.69 -0.03 -0.02 0.00 -1.00 0.00 0.00 29.16 28.79 4xia h TRP 305 CO -0.17 0.62 0.13 -0.44 -3.56 0.00 0.00 178.44 175.01 4xia h ASP 306 N 0.11 0.18 -0.65 -3.49 3.45 -0.61 -2.00 116.42 113.41 4xia h ASP 306 Ca 0.00 0.02 -0.04 0.00 0.43 0.00 0.00 57.03 57.44 4xia h ASP 306 Cb 0.93 -0.02 -0.03 0.00 -0.56 0.00 0.00 39.33 39.66 4xia h ASP 306 CO 0.07 0.14 0.26 0.77 -1.57 0.00 0.00 179.24 178.91 4xia h SER 307 N 0.27 0.90 -0.65 6.45 4.64 -0.05 -0.33 113.55 124.78 4xia h SER 307 Ca 0.12 -0.17 -0.08 0.00 -0.47 0.00 0.00 61.79 61.19 4xia h SER 307 Cb 0.05 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 61.88 4xia h SER 307 CO -0.09 0.83 0.11 0.00 -0.87 0.00 0.00 176.83 176.80 4xia h ALA 308 N 1.11 0.94 -0.17 5.18 0.00 -1.27 -2.68 119.26 122.37 4xia h ALA 308 Ca 0.22 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 4xia h ALA 308 Cb 0.21 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 4xia h ALA 308 CO -0.02 0.66 0.09 -0.22 0.00 0.00 0.00 179.25 179.76 4xia h LYS 309 N 1.02 0.25 -0.94 0.00 3.64 -1.14 -3.14 116.57 116.27 4xia h LYS 309 Ca 0.20 -0.04 0.10 0.00 -1.27 0.00 0.00 60.65 59.64 4xia h LYS 309 Cb 0.43 -0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 32.14 4xia h LYS 309 CO 0.01 0.28 0.60 0.00 -2.27 0.00 0.00 179.45 178.08 4xia h ALA 310 N 0.95 1.58 -0.11 5.00 0.00 -0.95 0.95 119.26 126.68 4xia h ALA 310 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 4xia h ALA 310 Cb 0.11 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 4xia h ALA 310 CO -0.01 0.23 0.07 -0.91 0.00 0.00 0.00 179.25 178.63 4xia h ASN 311 N 0.96 0.13 -0.28 0.00 2.35 -1.43 -1.28 115.58 116.03 4xia h ASN 311 Ca 0.44 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 56.13 4xia h ASN 311 Cb 0.40 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.72 4xia h ASN 311 CO -0.20 0.11 0.04 0.24 -1.65 0.00 0.00 177.43 175.97 4xia h MET 312 N 0.14 0.46 0.36 0.81 2.86 -1.33 -2.31 114.93 115.92 4xia h MET 312 Ca 0.04 -0.13 -0.00 0.00 -2.06 0.00 0.00 59.70 57.55 4xia h MET 312 Cb 0.00 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 4xia h MET 312 CO -0.01 0.59 -0.36 0.77 1.06 0.00 0.00 176.91 178.96 4xia h SER 313 N 0.27 -0.97 -0.30 1.22 0.02 -0.72 -1.16 113.55 111.91 4xia h SER 313 Ca 0.08 0.08 0.07 0.00 -0.84 0.00 0.00 61.79 61.18 4xia h SER 313 Cb 0.35 0.33 -0.08 0.00 0.14 0.00 0.00 62.40 63.14 4xia h SER 313 CO 0.01 -0.50 -0.33 0.24 -1.14 0.00 0.00 176.83 175.11 4xia h MET 314 N -0.74 -0.30 -0.68 3.45 2.07 -1.27 0.23 114.93 117.69 4xia h MET 314 Ca -0.02 0.02 0.05 0.00 -2.07 0.00 0.00 59.70 57.67 4xia h MET 314 Cb 0.67 0.07 -0.05 0.00 -1.87 0.00 0.00 31.60 30.42 4xia h MET 314 CO -0.06 -0.20 0.40 -0.92 1.07 0.00 0.00 176.91 177.20 4xia h TYR 315 N -0.31 0.74 -0.10 -0.22 5.03 -1.25 -0.89 116.97 119.97 4xia h TYR 315 Ca 0.14 0.02 -0.19 0.00 2.58 0.00 0.00 58.73 61.29 4xia h TYR 315 Cb 0.54 -0.24 -0.00 0.00 1.55 0.00 0.00 36.73 38.58 4xia h TYR 315 CO -0.49 0.39 -0.71 -0.07 -1.32 0.00 0.00 178.16 175.96 4xia h LEU 316 N 0.76 0.57 -0.47 2.82 3.38 -0.23 -0.46 115.31 121.68 4xia h LEU 316 Ca 0.29 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 4xia h LEU 316 Cb 0.12 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 4xia h LEU 316 CO -0.15 1.10 0.23 -0.07 0.09 0.00 0.00 178.44 179.64 4xia h LEU 317 N 0.33 0.61 -0.52 1.67 3.38 -0.28 -2.48 115.31 118.03 4xia h LEU 317 Ca -0.03 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.74 4xia h LEU 317 Cb 1.29 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 4xia h LEU 317 CO 0.13 0.56 0.01 -0.07 0.09 0.00 0.00 178.44 179.16 4xia h LEU 318 N 0.61 0.88 -0.59 1.67 3.38 -1.12 -2.47 115.31 117.67 4xia h LEU 318 Ca 0.16 -0.30 0.08 0.00 0.09 0.00 0.00 57.88 57.91 4xia h LEU 318 Cb 0.11 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.56 4xia h LEU 318 CO -0.02 0.97 0.26 0.50 0.09 0.00 0.00 178.44 180.23 4xia h LYS 319 N 0.77 0.45 0.60 1.13 3.64 -0.82 -0.11 116.57 122.23 4xia h LYS 319 Ca 0.15 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.48 4xia h LYS 319 Cb 0.51 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 4xia h LYS 319 CO 0.02 0.30 -0.40 1.49 -2.27 0.00 0.00 179.45 178.60 4xia h GLU 320 N 0.47 -0.92 -0.22 1.90 4.81 -1.44 -0.60 114.58 118.57 4xia h GLU 320 Ca 0.29 0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.52 4xia h GLU 320 Cb 0.30 0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 4xia h GLU 320 CO -0.25 -0.61 -0.11 0.00 -0.73 0.00 0.00 179.01 177.30 4xia h ARG 321 N -0.95 0.36 -0.10 1.92 3.08 -1.22 -0.99 114.38 116.48 4xia h ARG 321 Ca -0.07 -0.09 -0.15 0.00 0.07 0.00 0.00 59.98 59.74 4xia h ARG 321 Cb 0.78 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.78 4xia h ARG 321 CO 0.06 0.48 -0.59 0.00 -1.07 0.00 0.00 179.97 178.84 4xia h ALA 322 N 1.55 0.79 -0.06 0.04 0.00 -0.92 -1.60 119.26 119.06 4xia h ALA 322 Ca 0.07 -0.53 -0.05 0.00 0.00 0.00 0.00 54.91 54.39 4xia h ALA 322 Cb 0.41 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.12 4xia h ALA 322 CO 0.02 0.71 -0.16 -0.07 0.00 0.00 0.00 179.25 179.76 4xia h LEU 323 N 0.26 0.25 -0.49 0.00 3.38 -0.66 -2.63 115.31 115.41 4xia h LEU 323 Ca -0.00 -0.59 0.07 0.00 0.09 0.00 0.00 57.88 57.45 4xia h LEU 323 Cb 1.11 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.73 4xia h LEU 323 CO 0.10 0.80 0.16 0.00 0.09 0.00 0.00 178.44 179.58 4xia h ALA 324 N 0.46 0.59 -0.04 1.53 0.00 -1.16 -1.89 119.26 118.75 4xia h ALA 324 Ca -0.00 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.02 4xia h ALA 324 Cb 0.77 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.57 4xia h ALA 324 CO 0.03 -0.24 -0.23 0.35 0.00 0.00 0.00 179.25 179.16 4xia h PHE 325 N 0.32 -0.63 0.00 0.00 -0.00 -1.33 -2.10 116.94 113.20 4xia h PHE 325 Ca 0.24 0.02 -0.10 0.00 -0.00 0.00 0.00 57.97 58.14 4xia h PHE 325 Cb 0.27 0.28 -0.01 0.00 -0.00 0.00 0.00 35.95 36.49 4xia h PHE 325 CO -0.18 -0.32 -0.46 0.00 -0.00 0.00 0.00 178.31 177.35 4xia h ARG 326 N -0.35 0.00 0.00 1.11 2.47 -1.24 -3.18 114.38 113.19 4xia h ARG 326 Ca 0.07 0.00 -0.11 0.00 -1.26 0.00 0.00 59.98 58.69 4xia h ARG 326 Cb 0.45 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.75 4xia h ARG 326 CO -0.24 0.46 -0.51 0.00 0.56 0.00 0.00 179.97 180.24 4xia h ALA 327 N 1.54 0.89 -2.29 0.04 0.00 -1.19 -3.43 119.26 114.81 4xia h ALA 327 Ca -0.00 -0.47 -0.54 0.00 0.00 0.00 0.00 54.91 53.90 4xia h ALA 327 Cb 1.04 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.75 4xia h ALA 327 CO 0.06 0.64 1.16 0.34 0.00 0.00 0.00 179.25 181.45 4xia s ASP 328 N -6.57 6.54 0.36 0.00 -1.08 -0.80 -4.92 116.67 110.19 4xia s ASP 328 Ca 0.00 2.41 0.03 0.00 -0.52 0.00 0.00 52.55 54.47 4xia s ASP 328 Cb 0.11 -2.53 0.66 0.00 -1.46 0.00 0.00 42.92 39.70 4xia s ASP 328 CO 0.73 -1.01 2.01 -0.65 0.52 0.00 0.00 175.17 176.76 4xia h PRO 329 N 10.15 0.79 -0.72 4.34 0.11 -1.90 0.02 132.00 144.79 4xia h PRO 329 Ca -0.44 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.57 4xia h PRO 329 Cb 1.20 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.11 4xia h PRO 329 CO 0.95 0.53 0.27 0.93 -0.21 0.00 0.00 178.00 180.47 4xia h GLU 330 N 0.81 1.10 -0.24 1.05 4.39 -1.96 -2.02 114.58 117.72 4xia h GLU 330 Ca 0.22 -0.21 -0.04 0.00 0.34 0.00 0.00 59.36 59.67 4xia h GLU 330 Cb -0.08 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.39 4xia h GLU 330 CO -0.05 0.91 -0.01 0.28 -1.16 0.00 0.00 179.01 178.99 4xia h VAL 331 N 1.05 1.26 -0.79 3.13 2.07 -1.48 -1.09 116.25 120.40 4xia h VAL 331 Ca 0.24 -0.92 0.04 0.00 0.82 0.00 0.00 66.70 66.89 4xia h VAL 331 Cb 0.24 1.40 -0.05 0.00 -1.52 0.00 0.00 31.29 31.35 4xia h VAL 331 CO -0.02 0.29 0.49 1.56 0.02 0.00 0.00 177.57 179.91 4xia h GLN 332 N 0.19 0.90 -0.47 1.57 4.20 -0.92 -0.04 115.11 120.54 4xia h GLN 332 Ca 0.07 -0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.59 4xia h GLN 332 Cb 0.42 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 4xia h GLN 332 CO 0.01 0.60 -0.22 1.49 -0.67 0.00 0.00 178.83 180.04 4xia h GLU 333 N 0.93 0.96 -0.65 1.46 4.81 -1.30 -2.27 114.58 118.51 4xia h GLU 333 Ca 0.33 -0.41 -0.00 0.00 -0.13 0.00 0.00 59.36 59.15 4xia h GLU 333 Cb 0.08 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.40 4xia h GLU 333 CO -0.14 1.07 0.40 0.00 -0.73 0.00 0.00 179.01 179.61 4xia h ALA 334 N 0.91 0.83 -0.86 2.92 0.00 -0.50 -0.16 119.26 122.40 4xia h ALA 334 Ca 0.11 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 4xia h ALA 334 Cb 0.79 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 4xia h ALA 334 CO 0.07 0.30 0.45 0.52 0.00 0.00 0.00 179.25 180.58 4xia h MET 335 N 0.89 1.21 0.08 0.00 2.86 -1.00 -2.02 114.93 116.95 4xia h MET 335 Ca 0.23 -0.15 -0.00 0.00 -2.06 0.00 0.00 59.70 57.72 4xia h MET 335 Cb -0.04 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 31.39 4xia h MET 335 CO -0.05 0.90 -0.04 -0.22 1.06 0.00 0.00 176.91 178.57 4xia h LYS 336 N 1.21 -0.11 -0.72 1.72 3.64 -1.07 -0.71 116.57 120.54 4xia h LYS 336 Ca 0.30 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.78 4xia h LYS 336 Cb 0.06 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 31.84 4xia h LYS 336 CO -0.04 0.23 0.36 1.15 -2.27 0.00 0.00 179.45 178.88 4xia h THR 337 N -0.45 0.86 0.00 1.00 2.02 -0.71 -2.17 112.91 113.45 4xia h THR 337 Ca -0.01 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 66.96 4xia h THR 337 Cb 0.39 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.98 4xia h THR 337 CO 0.02 0.11 0.00 -1.20 0.37 0.00 0.00 175.52 174.82 4xia n SER 338 N -4.85 0.00 0.00 4.18 7.64 -0.79 -4.87 113.62 114.93 4xia n SER 338 Ca 0.11 0.41 0.00 0.00 1.01 0.00 0.00 58.87 60.40 4xia n SER 338 Cb 0.27 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 63.01 4xia n SER 338 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 4xia n GLY 339 N 0.20 0.43 0.28 0.23 0.00 -0.82 -4.96 105.19 100.56 4xia n GLY 339 Ca 0.05 -0.97 -0.06 0.00 0.00 0.00 0.00 46.02 45.04 4xia n GLY 339 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 4xia h VAL 340 N 0.00 1.22 0.04 1.61 2.07 -1.36 -1.99 116.25 117.85 4xia h VAL 340 Ca 0.00 -0.59 -0.25 0.00 0.82 0.00 0.00 66.70 66.67 4xia h VAL 340 Cb 0.33 0.37 0.01 0.00 -1.52 0.00 0.00 31.29 30.48 4xia h VAL 340 CO 0.00 0.25 -1.06 -0.26 0.02 0.00 0.00 177.57 176.52 4xia h PHE 341 N 0.93 0.70 -0.59 1.57 -1.00 -1.88 -3.24 116.94 113.44 4xia h PHE 341 Ca 0.23 -0.41 0.10 0.00 2.81 0.00 0.00 57.97 60.70 4xia h PHE 341 Cb 0.09 -0.07 -0.04 0.00 3.61 0.00 0.00 35.95 39.54 4xia h PHE 341 CO 0.00 1.26 0.40 1.49 -1.61 0.00 0.00 178.31 179.85 4xia h GLU 342 N 0.23 0.38 0.00 1.51 4.81 -1.78 -1.76 114.58 117.97 4xia h GLU 342 Ca -0.11 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.08 4xia h GLU 342 Cb 1.72 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 31.01 4xia h GLU 342 CO 0.19 0.25 -0.08 1.25 -0.73 0.00 0.00 179.01 179.89 4xia h LEU 343 N 0.39 0.00 -0.92 1.64 5.85 -1.39 -2.25 115.31 118.62 4xia h LEU 343 Ca 0.27 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.99 4xia h LEU 343 Cb 0.56 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.59 4xia h LEU 343 CO -0.07 0.08 0.00 1.23 -0.34 0.00 0.00 178.44 179.34 4xia h GLY 344 N 0.42 0.00 -3.45 3.75 0.00 -1.46 -3.45 103.07 98.88 4xia h GLY 344 Ca -0.00 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.83 4xia h GLY 344 CO 0.01 0.00 0.24 -0.54 0.00 0.00 0.00 176.54 176.25 4xia s GLU 345 N -3.46 4.49 0.57 4.80 2.02 -0.85 -5.02 118.70 121.26 4xia s GLU 345 Ca 0.04 1.16 -0.20 0.00 0.02 0.00 0.00 54.97 55.99 4xia s GLU 345 Cb 0.09 -2.93 -0.04 0.00 0.10 0.00 0.00 34.13 31.34 4xia s GLU 345 CO 0.52 0.38 1.23 0.95 0.02 0.00 0.00 175.26 178.36 4xia s THR 346 N -1.48 2.57 0.10 3.63 -4.23 -1.26 -4.93 115.64 110.04 4xia s THR 346 Ca 0.45 0.38 -0.17 0.00 -1.18 0.00 0.00 61.69 61.17 4xia s THR 346 Cb -0.19 -3.16 -0.06 0.00 1.34 0.00 0.00 72.50 70.42 4xia s THR 346 CO 0.24 -0.06 1.52 0.74 -0.54 0.00 0.00 174.62 176.52 4xia h THR 347 N 1.06 1.27 -3.44 3.99 2.02 -1.95 -3.44 112.91 112.43 4xia h THR 347 Ca -0.50 -1.03 -0.53 0.00 0.77 0.00 0.00 66.41 65.12 4xia h THR 347 Cb 1.29 1.32 -0.03 0.00 -1.74 0.00 0.00 68.15 69.00 4xia h THR 347 CO 0.56 0.33 -0.10 -0.76 0.37 0.00 0.00 175.52 175.91 4xia s LEU 348 N -9.38 4.15 0.52 2.58 1.43 -1.26 -5.08 118.68 111.64 4xia s LEU 348 Ca -0.13 0.92 -0.18 0.00 -1.03 0.00 0.00 54.13 53.71 4xia s LEU 348 Cb 0.08 -3.69 -0.07 0.00 0.03 0.00 0.00 46.19 42.54 4xia s LEU 348 CO 0.77 -0.09 1.01 0.20 0.23 0.00 0.00 176.35 178.47 4xia s ASN 349 N -2.43 6.37 -0.01 2.29 0.01 -1.26 -4.92 114.94 114.99 4xia s ASN 349 Ca 0.47 1.72 -0.37 0.00 -0.71 0.00 0.00 52.86 53.98 4xia s ASN 349 Cb -0.11 -2.53 -0.15 0.00 0.41 0.00 0.00 41.25 38.87 4xia s ASN 349 CO 0.22 -0.76 1.58 0.00 -1.51 0.00 0.00 177.10 176.62 4xia n ALA 350 N -1.48 0.02 -1.01 0.60 0.00 -1.26 0.11 120.51 117.49 4xia n ALA 350 Ca 0.08 0.43 -0.00 0.00 0.00 0.00 0.00 53.44 53.95 4xia n ALA 350 Cb 0.53 -2.24 -0.00 0.00 0.00 0.00 0.00 19.45 17.74 4xia n ALA 350 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 4xia n GLY 351 N 3.43 0.28 3.76 0.00 0.00 -1.26 -5.00 105.19 106.39 4xia n GLY 351 Ca 0.21 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 4xia n GLY 351 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 4xia s GLU 352 N -1.12 4.47 0.47 1.61 2.12 0.12 -5.05 118.70 121.32 4xia s GLU 352 Ca 0.00 1.02 0.08 0.00 0.36 0.00 0.00 54.97 56.43 4xia s GLU 352 Cb 0.00 -3.32 0.03 0.00 0.26 0.00 0.00 34.13 31.10 4xia s GLU 352 CO 0.00 0.40 0.65 -1.54 -0.54 0.00 0.00 175.26 174.22 4xia s SER 353 N -0.44 5.47 0.10 -1.70 1.04 -1.26 -4.78 113.70 112.13 4xia s SER 353 Ca 0.36 -0.49 -0.25 0.00 0.48 0.00 0.00 55.95 56.05 4xia s SER 353 Cb -0.21 -0.43 -0.12 0.00 0.10 0.00 0.00 66.02 65.36 4xia s SER 353 CO 0.23 -0.95 1.69 0.00 0.98 0.00 0.00 173.24 175.19 4xia h ALA 354 N 0.47 -0.22 -0.16 5.32 0.00 -1.99 0.60 119.26 123.28 4xia h ALA 354 Ca -0.38 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.56 4xia h ALA 354 Cb 1.28 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 19.18 4xia h ALA 354 CO 0.44 -0.64 -0.34 0.00 0.00 0.00 0.00 179.25 178.71 4xia h ALA 355 N 0.62 -0.40 -0.49 0.00 0.00 -2.01 -0.49 119.26 116.50 4xia h ALA 355 Ca 0.01 0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.03 4xia h ALA 355 Cb 0.25 0.66 -0.10 0.00 0.00 0.00 0.00 17.79 18.60 4xia h ALA 355 CO -0.04 -0.82 -0.35 -0.44 0.00 0.00 0.00 179.25 177.59 4xia h ASP 356 N -0.40 -1.20 -0.58 0.00 3.45 -1.74 -1.95 116.42 113.99 4xia h ASP 356 Ca 0.10 0.21 0.04 0.00 0.43 0.00 0.00 57.03 57.81 4xia h ASP 356 Cb 0.56 0.57 -0.04 0.00 -0.56 0.00 0.00 39.33 39.85 4xia h ASP 356 CO -0.38 -0.32 0.33 0.25 -1.57 0.00 0.00 179.24 177.54 4xia h LEU 357 N -0.23 0.50 -0.83 1.55 5.85 -0.05 -1.94 115.31 120.17 4xia h LEU 357 Ca 0.19 0.02 0.12 0.00 0.84 0.00 0.00 57.88 59.05 4xia h LEU 357 Cb 0.55 -0.08 -0.14 0.00 0.37 0.00 0.00 40.66 41.36 4xia h LEU 357 CO -0.61 0.34 -0.40 0.24 -0.34 0.00 0.00 178.44 177.67 4xia h MET 358 N 0.63 -0.08 0.00 1.25 2.86 -0.30 -2.09 114.93 117.20 4xia h MET 358 Ca 0.25 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.90 4xia h MET 358 Cb 0.11 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.78 4xia h MET 358 CO -0.14 -0.05 0.00 -1.71 1.06 0.00 0.00 176.91 176.07 4xia n ASN 359 N -5.43 0.31 -4.45 1.22 4.05 -1.22 -4.72 115.26 105.01 4xia n ASN 359 Ca 0.07 0.55 -0.43 0.00 0.45 0.00 0.00 54.58 55.21 4xia n ASN 359 Cb 0.37 -0.62 -0.04 0.00 1.23 0.00 0.00 39.78 40.72 4xia n ASN 359 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 4xia s ASP 360 N -3.57 6.18 0.49 1.20 3.68 -0.73 -4.94 116.67 118.97 4xia s ASP 360 Ca 0.10 -1.00 0.18 0.00 2.13 0.00 0.00 52.55 53.96 4xia s ASP 360 Cb 0.13 -2.41 1.21 0.00 -1.45 0.00 0.00 42.92 40.40 4xia s ASP 360 CO 0.45 -1.42 2.03 -1.28 0.13 0.00 0.00 175.17 175.08 4xia h SER 361 N 9.54 0.15 1.23 -0.34 0.87 -1.85 -2.04 113.55 121.12 4xia h SER 361 Ca -0.29 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.26 4xia h SER 361 Cb 1.07 -0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 63.00 4xia h SER 361 CO 1.17 0.10 -0.09 0.00 -0.53 0.00 0.00 176.83 177.48 4xia h ALA 362 N 1.78 0.99 -0.00 6.23 0.00 -1.92 1.18 119.26 127.51 4xia h ALA 362 Ca 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.02 4xia h ALA 362 Cb 0.56 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.33 4xia h ALA 362 CO -0.03 0.12 -0.34 0.43 0.00 0.00 0.00 179.25 179.43 4xia n SER 363 N -3.19 0.69 0.00 0.00 7.64 -0.77 -3.76 113.62 114.24 4xia n SER 363 Ca 0.01 -0.51 0.00 0.00 1.01 0.00 0.00 58.87 59.38 4xia n SER 363 Cb 0.41 0.14 0.00 0.00 -1.01 0.00 0.00 64.21 63.75 4xia n SER 363 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 4xia n PHE 364 N -1.09 -0.03 -0.12 1.43 7.35 -1.15 -4.81 117.46 119.04 4xia n PHE 364 Ca 0.09 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.74 4xia n PHE 364 Cb 0.34 0.02 0.02 0.00 0.35 0.00 0.00 39.48 40.20 4xia n PHE 364 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 4xia h ALA 365 N 0.33 0.25 -0.39 3.13 0.00 -1.76 -1.87 119.26 118.95 4xia h ALA 365 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.07 4xia h ALA 365 Cb 0.00 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.12 4xia h ALA 365 CO 0.00 -0.46 0.00 0.41 0.00 0.00 0.00 179.25 179.20 4xia n GLY 366 N -1.32 1.08 3.74 0.00 0.00 0.40 -4.97 105.19 104.12 4xia n GLY 366 Ca 0.02 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 4xia n GLY 366 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 4xia s PHE 367 N -1.52 3.64 -0.83 1.61 2.19 -0.70 -4.81 117.98 117.56 4xia s PHE 367 Ca 0.27 1.64 -0.16 0.00 0.33 0.00 0.00 56.93 59.01 4xia s PHE 367 Cb 0.15 -3.23 0.19 0.00 -1.31 0.00 0.00 43.02 38.82 4xia s PHE 367 CO 0.17 -0.45 0.85 0.34 1.83 0.00 0.00 175.22 177.96 4xia s ASP 368 N -0.09 6.67 0.24 6.13 3.68 -1.26 -4.86 116.67 127.19 4xia s ASP 368 Ca 0.49 -2.41 -0.04 0.00 2.13 0.00 0.00 52.55 52.71 4xia s ASP 368 Cb -0.28 -2.26 0.26 0.00 -1.45 0.00 0.00 42.92 39.18 4xia s ASP 368 CO 0.34 -0.74 1.74 0.00 0.13 0.00 0.00 175.17 176.64 4xia h ALA 369 N 8.18 1.05 -0.20 3.66 0.00 -1.95 -1.27 119.26 128.73 4xia h ALA 369 Ca 0.08 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.59 4xia h ALA 369 Cb 1.04 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 4xia h ALA 369 CO 0.88 0.60 -0.45 0.93 0.00 0.00 0.00 179.25 181.21 4xia h GLU 370 N 0.86 0.50 0.12 0.00 4.39 -1.99 -1.73 114.58 116.73 4xia h GLU 370 Ca 0.17 -0.27 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 4xia h GLU 370 Cb 0.43 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 4xia h GLU 370 CO 0.01 0.85 -0.06 0.00 -1.16 0.00 0.00 179.01 178.66 4xia h ALA 371 N 1.11 -0.16 -0.84 3.43 0.00 -1.80 -3.25 119.26 117.75 4xia h ALA 371 Ca 0.03 -0.19 0.17 0.00 0.00 0.00 0.00 54.91 54.91 4xia h ALA 371 Cb 0.94 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.69 4xia h ALA 371 CO 0.08 -0.39 0.39 0.00 0.00 0.00 0.00 179.25 179.33 4xia h ALA 372 N 0.27 1.28 0.00 0.00 0.00 -1.13 -1.46 119.26 118.21 4xia h ALA 372 Ca -0.02 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.01 4xia h ALA 372 Cb 0.44 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.28 4xia h ALA 372 CO 0.03 -0.19 0.00 0.00 0.00 0.00 0.00 179.25 179.08 4xia n ALA 373 N -2.47 1.17 0.29 0.00 0.00 -0.66 -2.64 120.51 116.21 4xia n ALA 373 Ca 0.18 0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.77 4xia n ALA 373 Cb 0.50 -1.13 0.17 0.00 0.00 0.00 0.00 19.45 18.99 4xia n ALA 373 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 4xia h GLU 374 N 0.00 0.00 -6.22 0.00 4.39 -1.36 -3.47 114.58 107.92 4xia h GLU 374 Ca 0.00 0.00 -0.70 0.00 0.34 0.00 0.00 59.36 59.00 4xia h GLU 374 Cb 0.07 0.00 0.05 0.00 -0.10 0.00 0.00 28.75 28.77 4xia h GLU 374 CO 0.00 0.00 0.41 -2.13 -1.16 0.00 0.00 179.01 176.13 4xia n ARG 375 N -2.79 0.96 -2.95 2.33 0.63 -1.08 -4.91 116.66 108.85 4xia n ARG 375 Ca 0.03 0.35 -0.43 0.00 -0.92 0.00 0.00 57.85 56.88 4xia n ARG 375 Cb 0.51 -1.97 -0.05 0.00 0.45 0.00 0.00 32.46 31.40 4xia n ARG 375 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 4xia s ASN 376 N 0.55 6.37 0.49 6.15 2.47 -1.26 -4.92 114.94 124.78 4xia s ASN 376 Ca 0.86 -0.28 0.28 0.00 0.42 0.00 0.00 52.86 54.14 4xia s ASN 376 Cb -1.01 -2.39 1.04 0.00 -1.45 0.00 0.00 41.25 37.44 4xia s ASN 376 CO 0.49 -1.01 1.87 -0.26 -3.72 0.00 0.00 177.10 174.47 4xia h PHE 377 N 9.08 0.00 -5.88 0.43 -1.00 -1.91 -3.46 116.94 114.20 4xia h PHE 377 Ca -0.25 0.00 -0.40 0.00 2.81 0.00 0.00 57.97 60.13 4xia h PHE 377 Cb 1.08 0.00 0.12 0.00 3.61 0.00 0.00 35.95 40.76 4xia h PHE 377 CO 0.83 0.11 -0.71 0.00 -1.61 0.00 0.00 178.31 176.93 4xia n ALA 378 N -2.16 -1.47 0.05 2.45 0.00 -1.26 -3.72 120.51 114.40 4xia n ALA 378 Ca 0.01 0.27 -0.06 0.00 0.00 0.00 0.00 53.44 53.66 4xia n ALA 378 Cb 0.39 -4.67 0.13 0.00 0.00 0.00 0.00 19.45 15.31 4xia n ALA 378 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 4xia h PHE 379 N -2.45 0.46 0.14 0.00 0.05 -1.95 -2.75 116.94 110.44 4xia h PHE 379 Ca -0.58 -0.15 -0.01 0.00 3.82 0.00 0.00 57.97 61.06 4xia h PHE 379 Cb 1.36 -0.09 0.00 0.00 2.00 0.00 0.00 35.95 39.22 4xia h PHE 379 CO 0.50 0.80 -0.07 0.82 -0.18 0.00 0.00 178.31 180.17 4xia h ILE 380 N 0.30 0.95 -0.37 -0.55 2.04 -1.99 -0.41 117.51 117.47 4xia h ILE 380 Ca 0.01 -0.37 0.02 0.00 1.00 0.00 0.00 64.86 65.53 4xia h ILE 380 Cb 0.98 1.18 -0.03 0.00 -0.74 0.00 0.00 36.82 38.21 4xia h ILE 380 CO 0.08 0.09 0.21 -0.09 0.00 0.00 0.00 178.15 178.44 4xia h ARG 381 N -0.36 0.41 -0.54 2.37 2.43 -1.94 -0.13 114.38 116.62 4xia h ARG 381 Ca -0.02 -0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.20 4xia h ARG 381 Cb 0.29 -0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 29.69 4xia h ARG 381 CO 0.03 0.27 0.22 1.25 -1.51 0.00 0.00 179.97 180.23 4xia h LEU 382 N 0.42 0.25 -0.57 3.80 5.85 -1.36 -1.37 115.31 122.32 4xia h LEU 382 Ca 0.15 0.06 -0.11 0.00 0.84 0.00 0.00 57.88 58.82 4xia h LEU 382 Cb 0.03 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 4xia h LEU 382 CO -0.08 0.17 -0.09 -1.13 -0.34 0.00 0.00 178.44 176.96 4xia h ASN 383 N 0.41 1.04 -0.82 1.25 -1.24 -0.24 -2.48 115.58 113.50 4xia h ASN 383 Ca 0.26 -0.34 -0.01 0.00 0.71 0.00 0.00 56.30 56.92 4xia h ASN 383 Cb 0.26 -0.28 -0.04 0.00 0.73 0.00 0.00 38.32 38.99 4xia h ASN 383 CO -0.24 1.14 0.48 -0.61 -1.29 0.00 0.00 177.43 176.91 4xia h GLN 384 N 0.93 1.13 -0.53 6.67 5.75 -0.27 -2.33 115.11 126.46 4xia h GLN 384 Ca 0.15 -0.11 -0.03 0.00 -0.15 0.00 0.00 58.65 58.51 4xia h GLN 384 Cb 0.66 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 28.95 4xia h GLN 384 CO 0.05 0.81 0.22 -0.07 -2.65 0.00 0.00 178.83 177.18 4xia h LEU 385 N 1.15 0.73 -0.28 -2.39 3.38 -1.02 -1.74 115.31 115.15 4xia h LEU 385 Ca 0.30 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 4xia h LEU 385 Cb -0.02 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 4xia h LEU 385 CO -0.05 0.70 0.10 0.00 0.09 0.00 0.00 178.44 179.28 4xia h ALA 386 N 1.06 0.36 -0.30 1.53 0.00 -0.99 -2.22 119.26 118.70 4xia h ALA 386 Ca 0.18 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 4xia h ALA 386 Cb 0.19 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 4xia h ALA 386 CO -0.02 -0.02 -0.12 0.82 0.00 0.00 0.00 179.25 179.91 4xia h ILE 387 N 0.29 1.23 -0.29 0.00 1.08 -1.38 0.84 117.51 119.28 4xia h ILE 387 Ca 0.09 -1.03 -0.12 0.00 -0.39 0.00 0.00 64.86 63.42 4xia h ILE 387 Cb 0.21 1.14 -0.01 0.00 -3.07 0.00 0.00 36.82 35.09 4xia h ILE 387 CO -0.00 0.34 -0.31 -0.33 -0.69 0.00 0.00 178.15 177.16 4xia h GLU 388 N 0.47 0.61 -0.45 2.37 5.08 -1.16 0.17 114.58 121.67 4xia h GLU 388 Ca 0.09 -0.27 -0.12 0.00 -1.00 0.00 0.00 59.36 58.06 4xia h GLU 388 Cb 0.50 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 4xia h GLU 388 CO 0.03 0.84 -0.19 0.45 -1.00 0.00 0.00 179.01 179.14 4xia h HIS 389 N 0.52 1.06 -0.73 4.33 3.86 -0.86 -0.93 115.15 122.40 4xia h HIS 389 Ca 0.06 -0.26 -0.02 0.00 -1.16 0.00 0.00 60.37 58.99 4xia h HIS 389 Cb 0.79 -0.25 -0.03 0.00 1.06 0.00 0.00 27.41 28.98 4xia h HIS 389 CO 0.03 1.05 0.37 1.25 0.86 0.00 0.00 177.93 181.50 4xia h LEU 390 N 0.76 0.94 0.00 2.43 5.85 -0.43 -2.75 115.31 122.11 4xia h LEU 390 Ca 0.10 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.70 4xia h LEU 390 Cb 0.76 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.55 4xia h LEU 390 CO 0.06 0.79 0.00 0.18 -0.34 0.00 0.00 178.44 179.13 4xia n LEU 391 N -4.43 0.00 -2.99 2.25 4.77 0.57 -4.91 117.00 112.25 4xia n LEU 391 Ca 0.06 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.84 4xia n LEU 391 Cb 0.11 -0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.26 4xia n LEU 391 CO 0.38 -0.00 0.13 0.61 -1.33 0.00 0.00 177.39 177.19 4xia n GLY 392 N 0.76 -0.36 0.06 -0.72 0.00 -1.04 -4.91 105.19 98.98 4xia n GLY 392 Ca 0.21 0.09 -0.01 0.00 0.00 0.00 0.00 46.02 46.31 4xia n GLY 392 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 4xia n SER 393 N -2.26 0.41 -0.14 1.61 3.41 -0.38 -5.03 113.62 111.25 4xia n SER 393 Ca -0.03 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 58.73 4xia n SER 393 Cb 0.57 1.35 0.83 0.00 -0.26 0.00 0.00 64.21 66.71 4xia n SER 393 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42