#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xlj n GLN 3 N 0.00 -3.04 -2.31 7.34 3.00 -1.26 -5.02 117.38 116.09 1xlj n GLN 3 Ca 0.00 2.46 -0.34 0.00 -0.01 0.00 0.00 57.00 59.12 1xlj n GLN 3 Cb 0.00 -3.81 -0.01 0.00 0.00 0.00 0.00 30.24 26.42 1xlj n GLN 3 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1xlj s PRO 4 N -0.83 3.55 0.02 -1.09 0.04 -1.26 -5.06 135.00 130.37 1xlj s PRO 4 Ca -0.17 1.33 -0.02 0.00 0.04 0.00 0.00 61.00 62.18 1xlj s PRO 4 Cb 0.01 -2.06 -0.02 0.00 0.04 0.00 0.00 34.50 32.48 1xlj s PRO 4 CO 0.54 -0.64 0.02 0.95 0.04 0.00 0.00 177.00 177.92 1xlj s THR 5 N -2.14 0.12 0.44 1.26 -4.23 -1.26 -4.69 115.64 105.13 1xlj s THR 5 Ca 0.67 -0.96 0.39 0.00 -1.18 0.00 0.00 61.69 60.60 1xlj s THR 5 Cb -0.17 -0.48 0.57 0.00 1.34 0.00 0.00 72.50 73.76 1xlj s THR 5 CO 0.28 -0.53 1.26 -2.65 -0.54 0.00 0.00 174.62 172.43 1xlj n PRO 6 N 1.34 -0.00 0.00 3.99 -0.02 -1.20 -0.51 135.00 138.58 1xlj n PRO 6 Ca -0.22 0.89 0.14 0.00 -2.02 0.00 0.00 63.50 62.29 1xlj n PRO 6 Cb 0.56 -2.01 0.77 0.00 -0.02 0.00 0.00 33.50 32.80 1xlj n PRO 6 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xlj n ALA 7 N -2.72 2.47 0.25 3.55 0.00 -1.26 -2.87 120.51 119.94 1xlj n ALA 7 Ca 0.36 -0.15 0.14 0.00 0.00 0.00 0.00 53.44 53.79 1xlj n ALA 7 Cb 1.58 -1.47 0.47 0.00 0.00 0.00 0.00 19.45 20.04 1xlj n ALA 7 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1xlj h ASP 8 N 0.00 0.00 -5.62 0.00 3.32 -1.18 -3.48 116.42 109.46 1xlj h ASP 8 Ca 0.00 0.00 -0.37 0.00 0.02 0.00 0.00 57.03 56.68 1xlj h ASP 8 Cb 0.18 0.00 0.14 0.00 0.22 0.00 0.00 39.33 39.87 1xlj h ASP 8 CO 0.00 0.03 -0.67 1.41 -1.72 0.00 0.00 179.24 178.30 1xlj n HIS 9 N -3.12 -2.66 -2.66 4.55 8.25 -1.14 -4.68 115.22 113.76 1xlj n HIS 9 Ca 0.02 0.96 -0.43 0.00 -0.26 0.00 0.00 57.72 58.01 1xlj n HIS 9 Cb 0.40 -4.90 -0.02 0.00 1.12 0.00 0.00 29.99 26.60 1xlj n HIS 9 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1xlj s PHE 10 N -3.31 3.05 0.11 4.41 0.08 -1.26 -0.87 117.98 120.19 1xlj s PHE 10 Ca 0.47 1.00 0.07 0.00 0.12 0.00 0.00 56.93 58.59 1xlj s PHE 10 Cb -0.21 -3.88 -0.04 0.00 -0.57 0.00 0.00 43.02 38.33 1xlj s PHE 10 CO 0.70 -0.91 -0.09 0.95 -0.10 0.00 0.00 175.22 175.77 1xlj s THR 11 N 3.83 3.40 0.02 0.64 -4.23 -0.39 -0.11 115.64 118.80 1xlj s THR 11 Ca 0.45 -1.30 0.02 0.00 -1.18 0.00 0.00 61.69 59.68 1xlj s THR 11 Cb -0.11 -2.61 -0.02 0.00 1.34 0.00 0.00 72.50 71.11 1xlj s THR 11 CO 0.20 0.08 -0.08 -0.36 -0.54 0.00 0.00 174.62 173.93 1xlj s PHE 12 N -1.28 0.67 0.27 3.99 0.40 -1.19 -1.66 117.98 119.18 1xlj s PHE 12 Ca 0.22 -0.32 -0.06 0.00 -0.60 0.00 0.00 56.93 56.17 1xlj s PHE 12 Cb -0.11 -0.41 -0.06 0.00 0.51 0.00 0.00 43.02 42.95 1xlj s PHE 12 CO 0.14 -0.04 0.56 0.20 0.70 0.00 0.00 175.22 176.78 1xlj s GLY 13 N -0.94 1.98 0.36 4.36 0.00 -1.25 -1.47 107.32 110.36 1xlj s GLY 13 Ca -0.04 -0.47 0.03 0.00 0.00 0.00 0.00 44.72 44.25 1xlj s GLY 13 CO 0.00 -0.36 2.02 -2.00 0.00 0.00 0.00 173.10 172.76 1xlj h LEU 14 N 1.92 0.65 -0.26 0.66 5.85 -1.20 -2.37 115.31 120.57 1xlj h LEU 14 Ca -0.47 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.22 1xlj h LEU 14 Cb 1.18 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.05 1xlj h LEU 14 CO 0.67 0.48 0.00 -2.67 -0.34 0.00 0.00 178.44 176.58 1xlj n TRP 15 N -4.44 0.40 0.00 1.25 2.14 -1.26 -1.57 117.44 113.96 1xlj n TRP 15 Ca 0.05 0.15 0.00 0.00 2.07 0.00 0.00 57.50 59.77 1xlj n TRP 15 Cb 0.05 -0.74 0.00 0.00 -0.81 0.00 0.00 31.31 29.82 1xlj n TRP 15 CO 0.00 0.00 0.00 0.25 2.07 0.00 0.00 177.69 180.01 1xlj n THR 16 N -1.85 0.00 0.16 -1.67 -2.24 -0.89 -2.37 114.28 105.42 1xlj n THR 16 Ca 0.04 0.71 0.02 0.00 -2.27 0.00 0.00 64.05 62.54 1xlj n THR 16 Cb 0.24 -1.67 0.35 0.00 -2.10 0.00 0.00 70.33 67.15 1xlj n THR 16 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 1xlj h VAL 17 N 0.00 1.25 0.00 2.28 -1.51 -1.69 -1.79 116.25 114.79 1xlj h VAL 17 Ca 0.00 -1.21 0.00 0.00 -1.23 0.00 0.00 66.70 64.26 1xlj h VAL 17 Cb 0.00 1.60 0.00 0.00 -2.13 0.00 0.00 31.29 30.76 1xlj h VAL 17 CO 0.00 0.35 0.00 0.61 -1.23 0.00 0.00 177.57 177.30 1xlj n GLY 18 N -0.50 -1.24 3.65 5.19 0.00 -0.61 -4.83 105.19 106.85 1xlj n GLY 18 Ca -0.02 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 1xlj n GLY 18 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1xlj s TRP 19 N -2.76 1.59 -1.13 1.61 -0.00 -0.67 -4.56 118.94 113.03 1xlj s TRP 19 Ca 0.19 0.02 0.27 0.00 -0.00 0.00 0.00 56.10 56.57 1xlj s TRP 19 Cb 0.17 -4.07 0.80 0.00 -0.00 0.00 0.00 33.47 30.37 1xlj s TRP 19 CO 0.42 -4.47 1.61 2.41 -0.00 0.00 0.00 176.95 176.92 1xlj n THR 20 N 5.96 0.00 0.00 5.86 -1.04 -1.26 -4.81 114.28 118.99 1xlj n THR 20 Ca 0.20 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.20 1xlj n THR 20 Cb 0.43 0.02 0.00 0.00 -1.82 0.00 0.00 70.33 68.96 1xlj n THR 20 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xlj n GLY 21 N 1.46 1.12 3.73 3.41 0.00 -1.26 -0.09 105.19 113.56 1xlj n GLY 21 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1xlj n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xlj s ALA 22 N -2.00 3.28 0.00 4.61 0.00 -1.26 -4.32 121.76 122.08 1xlj s ALA 22 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 51.96 52.41 1xlj s ALA 22 Cb 0.00 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.95 1xlj s ALA 22 CO 0.00 -0.02 0.00 -0.40 0.00 0.00 0.00 175.76 175.34 1xlj n ASP 23 N 2.95 1.61 -0.07 0.00 5.68 -0.77 -4.97 116.55 120.99 1xlj n ASP 23 Ca 0.01 -0.97 -0.01 0.00 -0.50 0.00 0.00 54.79 53.32 1xlj n ASP 23 Cb 0.50 0.00 0.26 0.00 -1.14 0.00 0.00 41.12 40.74 1xlj n ASP 23 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 1xlj h PRO 24 N 0.00 0.69 -0.66 0.11 0.11 -2.02 -3.06 132.00 127.17 1xlj h PRO 24 Ca 0.00 -0.12 0.00 0.00 0.11 0.00 0.00 66.00 65.99 1xlj h PRO 24 Cb 0.00 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.00 1xlj h PRO 24 CO 0.00 0.62 0.00 1.19 -0.21 0.00 0.00 178.00 179.60 1xlj n PHE 25 N -4.31 1.45 -3.63 0.65 3.01 -1.26 -5.03 117.46 108.34 1xlj n PHE 25 Ca 0.03 -0.58 0.01 0.00 1.01 0.00 0.00 57.45 57.92 1xlj n PHE 25 Cb 0.20 -0.24 -0.01 0.00 -0.01 0.00 0.00 39.48 39.43 1xlj n PHE 25 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1xlj s GLY 26 N -0.88 -0.40 0.54 1.37 0.00 -1.16 -5.16 107.32 101.64 1xlj s GLY 26 Ca 0.50 0.71 -0.00 0.00 0.00 0.00 0.00 44.72 45.93 1xlj s GLY 26 CO 0.24 0.14 0.78 -1.34 0.00 0.00 0.00 173.10 172.92 1xlj s VAL 27 N -2.48 3.09 0.62 1.40 -7.23 -1.26 -1.84 120.40 112.69 1xlj s VAL 27 Ca 0.14 -0.53 -0.19 0.00 -1.81 0.00 0.00 61.98 59.59 1xlj s VAL 27 Cb 0.04 -3.17 -0.02 0.00 0.56 0.00 0.00 36.38 33.79 1xlj s VAL 27 CO -0.04 -0.13 1.31 0.00 -0.31 0.00 0.00 175.10 175.93 1xlj n ALA 28 N -2.34 1.26 0.02 1.32 0.00 -1.26 -4.34 120.51 115.16 1xlj n ALA 28 Ca 0.06 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1xlj n ALA 28 Cb 0.59 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.71 1xlj n ALA 28 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1xlj n THR 29 N -1.69 0.00 -4.16 0.00 -2.24 0.86 -4.94 114.28 102.12 1xlj n THR 29 Ca 0.14 -0.50 -0.17 0.00 -2.27 0.00 0.00 64.05 61.25 1xlj n THR 29 Cb 0.47 1.01 -0.12 0.00 -2.10 0.00 0.00 70.33 69.59 1xlj n THR 29 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1xlj s ARG 30 N -0.32 0.76 0.62 -0.78 0.52 -0.97 -5.00 118.95 113.77 1xlj s ARG 30 Ca 0.00 -0.89 -0.14 0.00 -0.52 0.00 0.00 55.73 54.19 1xlj s ARG 30 Cb 0.00 -0.72 -0.03 0.00 0.52 0.00 0.00 34.95 34.73 1xlj s ARG 30 CO 0.01 0.16 1.05 -1.59 0.02 0.00 0.00 175.30 174.94 1xlj s LYS 31 N -1.65 3.30 0.52 3.54 0.00 -1.26 -4.81 119.74 119.37 1xlj s LYS 31 Ca -0.03 1.04 -0.22 0.00 0.00 0.00 0.00 55.97 56.75 1xlj s LYS 31 Cb -0.10 -2.04 -0.07 0.00 0.00 0.00 0.00 37.83 35.63 1xlj s LYS 31 CO 0.02 -0.82 1.16 0.09 0.00 0.00 0.00 175.35 175.80 1xlj n ASN 32 N -2.43 1.82 -4.64 0.03 4.13 -1.26 -4.92 115.26 107.99 1xlj n ASN 32 Ca 0.08 0.96 -0.37 0.00 1.68 0.00 0.00 54.58 56.92 1xlj n ASN 32 Cb 0.53 -1.47 -0.10 0.00 -1.54 0.00 0.00 39.78 37.21 1xlj n ASN 32 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1xlj s LEU 33 N -2.17 4.08 0.17 3.41 2.96 -1.26 -5.05 118.68 120.82 1xlj s LEU 33 Ca 0.69 0.12 -0.31 0.00 -0.22 0.00 0.00 54.13 54.42 1xlj s LEU 33 Cb -0.46 -2.16 -0.09 0.00 0.50 0.00 0.00 46.19 43.98 1xlj s LEU 33 CO 0.51 0.00 1.37 -0.62 -1.32 0.00 0.00 176.35 176.29 1xlj s ASP 34 N 1.31 6.83 0.48 3.68 -1.08 -1.26 -4.90 116.67 121.72 1xlj s ASP 34 Ca 0.09 2.41 0.16 0.00 -0.52 0.00 0.00 52.55 54.69 1xlj s ASP 34 Cb -0.14 -2.60 1.18 0.00 -1.46 0.00 0.00 42.92 39.89 1xlj s ASP 34 CO 0.07 -0.61 2.06 1.55 0.52 0.00 0.00 175.17 178.76 1xlj h PRO 35 N 5.99 0.18 -0.17 4.34 0.13 -1.96 -1.17 132.00 139.34 1xlj h PRO 35 Ca -0.44 -0.01 -0.16 0.00 -0.87 0.00 0.00 66.00 64.52 1xlj h PRO 35 Cb 1.21 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 1xlj h PRO 35 CO 0.82 0.12 -0.57 0.28 -0.23 0.00 0.00 178.00 178.42 1xlj h VAL 36 N 0.19 1.33 -0.20 1.56 2.07 -1.93 -1.47 116.25 117.79 1xlj h VAL 36 Ca 0.14 -1.83 -0.01 0.00 0.82 0.00 0.00 66.70 65.82 1xlj h VAL 36 Cb 0.34 1.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.91 1xlj h VAL 36 CO -0.02 0.57 0.09 -0.33 0.02 0.00 0.00 177.57 177.89 1xlj h GLU 37 N 0.40 0.29 -0.11 1.57 5.08 -1.64 -2.44 114.58 117.73 1xlj h GLU 37 Ca 0.00 -0.05 0.04 0.00 -1.00 0.00 0.00 59.36 58.36 1xlj h GLU 37 Cb 1.11 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 30.25 1xlj h GLU 37 CO 0.11 0.33 -0.44 0.00 -1.00 0.00 0.00 179.01 178.01 1xlj h ALA 38 N 0.94 -0.65 -0.14 3.43 0.00 -1.18 0.58 119.26 122.24 1xlj h ALA 38 Ca 0.07 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.99 1xlj h ALA 38 Cb 0.14 0.82 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 1xlj h ALA 38 CO -0.01 -0.96 -0.07 0.28 0.00 0.00 0.00 179.25 178.49 1xlj h VAL 39 N -0.52 0.77 0.43 0.00 2.07 -1.20 0.11 116.25 117.90 1xlj h VAL 39 Ca 0.07 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.56 1xlj h VAL 39 Cb 0.64 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1xlj h VAL 39 CO -0.40 0.00 -0.21 0.45 0.02 0.00 0.00 177.57 177.44 1xlj h HIS 40 N -0.06 -0.54 -0.38 1.57 -0.00 -0.97 -1.22 115.15 113.54 1xlj h HIS 40 Ca 0.08 -0.01 0.07 0.00 -0.00 0.00 0.00 60.37 60.50 1xlj h HIS 40 Cb 0.18 0.18 -0.06 0.00 -0.00 0.00 0.00 27.41 27.71 1xlj h HIS 40 CO -0.21 -0.32 0.03 -0.22 -0.00 0.00 0.00 177.93 177.21 1xlj h LYS 41 N -0.62 0.13 -0.18 2.45 1.63 0.37 -1.76 116.57 118.58 1xlj h LYS 41 Ca -0.06 -0.01 0.02 0.00 -0.85 0.00 0.00 60.65 59.75 1xlj h LYS 41 Cb 0.47 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.05 1xlj h LYS 41 CO 0.10 0.09 0.07 -0.07 -3.45 0.00 0.00 179.45 176.18 1xlj h LEU 42 N 0.14 0.08 -0.88 5.20 3.38 -0.71 -2.44 115.31 120.07 1xlj h LEU 42 Ca 0.19 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.19 1xlj h LEU 42 Cb 0.25 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 1xlj h LEU 42 CO -0.29 0.07 0.58 0.00 0.09 0.00 0.00 178.44 178.90 1xlj h ALA 43 N 1.11 1.13 -0.67 1.53 0.00 -0.85 -2.47 119.26 119.04 1xlj h ALA 43 Ca 0.08 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1xlj h ALA 43 Cb 0.04 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 1xlj h ALA 43 CO -0.08 0.49 0.44 0.93 0.00 0.00 0.00 179.25 181.03 1xlj h GLU 44 N 1.17 0.89 0.00 0.00 5.08 -1.05 -2.44 114.58 118.22 1xlj h GLU 44 Ca 0.33 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 1xlj h GLU 44 Cb -0.09 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 28.96 1xlj h GLU 44 CO -0.09 0.59 0.00 -0.07 -1.00 0.00 0.00 179.01 178.44 1xlj h LEU 45 N 0.91 0.00 0.00 1.33 3.38 -0.98 -3.47 115.31 116.48 1xlj h LEU 45 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1xlj h LEU 45 Cb -0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1xlj h LEU 45 CO -0.05 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.09 1xlj n GLY 46 N -0.11 1.24 3.79 0.83 0.00 -0.92 -4.74 105.19 105.28 1xlj n GLY 46 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1xlj n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xlj s ALA 47 N -2.00 2.46 -0.16 4.61 0.00 -1.09 -3.27 121.76 122.31 1xlj s ALA 47 Ca 0.00 0.23 0.19 0.00 0.00 0.00 0.00 51.96 52.37 1xlj s ALA 47 Cb 0.00 -3.24 -0.27 0.00 0.00 0.00 0.00 23.12 19.62 1xlj s ALA 47 CO 0.00 -1.47 0.18 0.98 0.00 0.00 0.00 175.76 175.45 1xlj n TYR 48 N -3.21 0.03 -3.82 0.00 9.36 0.84 -4.58 117.16 115.78 1xlj n TYR 48 Ca 0.09 0.01 -0.06 0.00 3.32 0.00 0.00 57.90 61.26 1xlj n TYR 48 Cb 0.53 -0.89 -0.01 0.00 -0.63 0.00 0.00 39.34 38.34 1xlj n TYR 48 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 1xlj s GLY 49 N -5.26 -0.05 0.01 2.98 0.00 -1.20 -2.72 107.32 101.07 1xlj s GLY 49 Ca -0.09 -0.23 0.01 0.00 0.00 0.00 0.00 44.72 44.41 1xlj s GLY 49 CO 0.85 0.16 -0.04 -1.50 0.00 0.00 0.00 173.10 172.56 1xlj s ILE 50 N -3.26 0.29 0.23 0.90 2.07 -0.80 -3.19 121.20 117.44 1xlj s ILE 50 Ca 0.13 -0.56 0.09 0.00 -1.41 0.00 0.00 60.65 58.90 1xlj s ILE 50 Cb -0.04 -0.33 -0.05 0.00 0.13 0.00 0.00 42.46 42.18 1xlj s ILE 50 CO 0.06 -0.18 -0.16 0.42 -1.91 0.00 0.00 174.94 173.16 1xlj s THR 51 N -0.74 1.98 0.16 4.00 -4.23 -0.54 -3.81 115.64 112.47 1xlj s THR 51 Ca -0.06 -2.28 -0.20 0.00 -1.18 0.00 0.00 61.69 57.98 1xlj s THR 51 Cb -0.06 -2.13 0.05 0.00 1.34 0.00 0.00 72.50 71.71 1xlj s THR 51 CO -0.00 -0.53 0.54 0.72 -0.54 0.00 0.00 174.62 174.81 1xlj s PHE 52 N -2.81 -0.37 -0.04 3.99 -0.12 -1.24 -0.51 117.98 116.87 1xlj s PHE 52 Ca 0.25 0.10 -0.09 0.00 -0.05 0.00 0.00 56.93 57.14 1xlj s PHE 52 Cb -0.02 0.46 -0.05 0.00 -0.63 0.00 0.00 43.02 42.78 1xlj s PHE 52 CO 0.10 -0.83 0.26 -1.01 -0.05 0.00 0.00 175.22 173.68 1xlj s HIS 53 N -3.79 3.64 0.21 3.49 3.76 -1.25 -0.87 115.29 120.47 1xlj s HIS 53 Ca 0.03 0.70 -0.19 0.00 -0.15 0.00 0.00 55.06 55.45 1xlj s HIS 53 Cb -0.00 -2.07 0.18 0.00 1.11 0.00 0.00 32.58 31.79 1xlj s HIS 53 CO -0.10 0.67 1.57 0.38 -0.85 0.00 0.00 174.74 176.40 1xlj h ASP 54 N 4.62 -1.35 0.31 1.40 2.03 -1.71 0.22 116.42 121.95 1xlj h ASP 54 Ca -0.53 0.28 0.00 0.00 -0.73 0.00 0.00 57.03 56.05 1xlj h ASP 54 Cb 1.22 0.69 0.00 0.00 -0.83 0.00 0.00 39.33 40.41 1xlj h ASP 54 CO 0.61 -0.30 0.00 0.59 -1.03 0.00 0.00 179.24 179.12 1xlj n ASN 55 N -5.45 0.00 -0.09 4.15 5.03 -1.24 0.34 115.26 118.00 1xlj n ASN 55 Ca 0.07 -0.19 -0.12 0.00 0.87 0.00 0.00 54.58 55.21 1xlj n ASN 55 Cb 0.38 -0.22 -0.05 0.00 -1.02 0.00 0.00 39.78 38.87 1xlj n ASN 55 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.26 175.87 1xlj h ASP 56 N 0.00 0.57 0.00 6.41 3.32 -0.95 -3.36 116.42 122.41 1xlj h ASP 56 Ca 0.00 -0.42 -0.22 0.00 0.02 0.00 0.00 57.03 56.40 1xlj h ASP 56 Cb 0.16 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 1xlj h ASP 56 CO 0.00 0.87 -1.45 -0.11 -1.72 0.00 0.00 179.24 176.83 1xlj n LEU 57 N -4.45 1.89 -4.32 1.55 7.94 -1.01 -4.92 117.00 113.68 1xlj n LEU 57 Ca -0.04 0.43 -0.36 0.00 -1.11 0.00 0.00 56.01 54.93 1xlj n LEU 57 Cb 0.37 -0.87 -0.13 0.00 0.53 0.00 0.00 43.42 43.31 1xlj n LEU 57 CO 0.41 0.14 -0.32 -0.63 -1.11 0.00 0.00 177.39 175.88 1xlj s ILE 58 N -2.46 3.69 0.51 1.96 1.01 0.15 -5.03 121.20 121.03 1xlj s ILE 58 Ca -0.29 -0.66 -0.19 0.00 0.00 0.00 0.00 60.65 59.50 1xlj s ILE 58 Cb 0.07 -2.84 -0.11 0.00 0.01 0.00 0.00 42.46 39.59 1xlj s ILE 58 CO 0.47 0.19 0.37 -2.65 0.00 0.00 0.00 174.94 173.32 1xlj n PRO 59 N 4.82 0.40 -0.11 2.79 -0.02 -1.26 -3.73 135.00 137.89 1xlj n PRO 59 Ca -0.16 0.15 0.07 0.00 -2.02 0.00 0.00 63.50 61.55 1xlj n PRO 59 Cb 0.49 -1.47 0.41 0.00 -0.02 0.00 0.00 33.50 32.91 1xlj n PRO 59 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1xlj h PHE 60 N 0.33 0.61 -0.20 6.00 3.57 -1.94 -2.67 116.94 122.64 1xlj h PHE 60 Ca -0.43 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.09 1xlj h PHE 60 Cb 1.41 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 39.95 1xlj h PHE 60 CO 0.30 0.33 0.00 -0.40 -2.23 0.00 0.00 178.31 176.31 1xlj n ASP 61 N -4.47 2.59 -4.55 0.41 5.75 -1.26 -5.02 116.55 110.00 1xlj n ASP 61 Ca 0.08 -1.76 -0.38 0.00 -0.01 0.00 0.00 54.79 52.72 1xlj n ASP 61 Cb 0.23 -0.13 0.04 0.00 -1.03 0.00 0.00 41.12 40.23 1xlj n ASP 61 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1xlj n ALA 62 N 0.77 -0.44 -1.94 2.12 0.00 -1.01 -4.98 120.51 115.03 1xlj n ALA 62 Ca 0.11 0.03 -0.27 0.00 0.00 0.00 0.00 53.44 53.31 1xlj n ALA 62 Cb 0.40 -1.98 0.10 0.00 0.00 0.00 0.00 19.45 17.98 1xlj n ALA 62 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1xlj s THR 63 N -1.57 2.16 0.40 0.00 -4.23 -1.26 -4.86 115.64 106.28 1xlj s THR 63 Ca 0.71 -0.24 0.16 0.00 -1.18 0.00 0.00 61.69 61.14 1xlj s THR 63 Cb -0.45 -2.93 0.17 0.00 1.34 0.00 0.00 72.50 70.63 1xlj s THR 63 CO 0.52 0.00 1.93 1.05 -0.54 0.00 0.00 174.62 177.58 1xlj h GLU 64 N -0.87 0.00 -0.19 3.99 9.09 -2.00 -1.03 114.58 123.58 1xlj h GLU 64 Ca -0.43 0.00 -0.08 0.00 0.05 0.00 0.00 59.36 58.90 1xlj h GLU 64 Cb 1.29 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.39 1xlj h GLU 64 CO 0.52 0.25 -0.19 0.00 0.05 0.00 0.00 179.01 179.65 1xlj h ALA 65 N 1.75 0.28 -0.27 1.06 0.00 -2.00 -2.97 119.26 117.11 1xlj h ALA 65 Ca -0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 1xlj h ALA 65 Cb 0.48 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1xlj h ALA 65 CO 0.03 0.20 0.09 0.93 0.00 0.00 0.00 179.25 180.50 1xlj h GLU 66 N 0.13 0.42 -0.41 0.00 5.08 -1.71 -2.13 114.58 115.95 1xlj h GLU 66 Ca 0.03 -0.09 0.08 0.00 -1.00 0.00 0.00 59.36 58.38 1xlj h GLU 66 Cb 0.73 -0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.85 1xlj h GLU 66 CO 0.05 0.48 -0.04 -0.09 -1.00 0.00 0.00 179.01 178.41 1xlj h ARG 67 N 0.27 0.06 -0.15 2.33 2.43 -1.26 -0.16 114.38 117.90 1xlj h ARG 67 Ca 0.09 -0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.16 1xlj h ARG 67 Cb 0.24 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1xlj h ARG 67 CO -0.00 0.04 -0.30 0.93 -1.51 0.00 0.00 179.97 179.13 1xlj h GLU 68 N 0.07 0.29 0.67 0.20 5.08 -1.47 -0.54 114.58 118.87 1xlj h GLU 68 Ca 0.20 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 1xlj h GLU 68 Cb 0.30 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.54 1xlj h GLU 68 CO -0.37 0.57 -0.32 -0.22 -1.00 0.00 0.00 179.01 177.67 1xlj h LYS 69 N 0.26 -0.86 -0.28 2.33 3.11 -0.63 -1.65 116.57 118.84 1xlj h LYS 69 Ca 0.04 0.06 0.07 0.00 -2.81 0.00 0.00 60.65 58.00 1xlj h LYS 69 Cb 0.67 0.20 -0.07 0.00 -1.00 0.00 0.00 32.23 32.02 1xlj h LYS 69 CO 0.05 -0.54 -0.19 0.82 -2.81 0.00 0.00 179.45 176.78 1xlj h ILE 70 N -1.02 0.48 -0.26 2.00 2.04 -0.94 -2.41 117.51 117.40 1xlj h ILE 70 Ca -0.09 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.75 1xlj h ILE 70 Cb 0.72 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 1xlj h ILE 70 CO 0.15 0.00 0.08 -0.07 0.00 0.00 0.00 178.15 178.31 1xlj h LEU 71 N -0.16 0.32 -0.02 1.44 3.38 -1.08 -1.80 115.31 117.38 1xlj h LEU 71 Ca 0.15 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1xlj h LEU 71 Cb 0.39 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 1xlj h LEU 71 CO -0.38 0.32 0.00 1.23 0.09 0.00 0.00 178.44 179.70 1xlj h GLY 72 N 0.54 0.04 1.44 0.83 0.00 -0.82 0.32 103.07 105.41 1xlj h GLY 72 Ca 0.09 -0.03 -0.12 0.00 0.00 0.00 0.00 47.33 47.27 1xlj h GLY 72 CO -0.01 0.03 -0.32 -0.55 0.00 0.00 0.00 176.54 175.69 1xlj h ASP 73 N -0.21 0.65 -0.04 0.19 3.32 -1.30 -2.22 116.42 116.81 1xlj h ASP 73 Ca 0.01 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 56.79 1xlj h ASP 73 Cb 0.27 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 1xlj h ASP 73 CO 0.00 0.93 -0.01 0.15 -1.72 0.00 0.00 179.24 178.59 1xlj h PHE 74 N 0.53 0.08 -0.62 4.55 3.57 -1.25 -2.17 116.94 121.63 1xlj h PHE 74 Ca 0.06 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 1xlj h PHE 74 Cb 0.82 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.51 1xlj h PHE 74 CO 0.04 0.41 0.26 -0.91 -2.23 0.00 0.00 178.31 175.88 1xlj h ASN 75 N -0.27 0.82 -0.10 0.41 4.21 -0.30 -2.38 115.58 117.97 1xlj h ASN 75 Ca 0.01 -0.10 0.03 0.00 1.21 0.00 0.00 56.30 57.45 1xlj h ASN 75 Cb 0.38 -0.21 -0.03 0.00 -1.12 0.00 0.00 38.32 37.34 1xlj h ASN 75 CO 0.00 0.72 -0.07 -0.61 -1.29 0.00 0.00 177.43 176.18 1xlj h GLN 76 N 0.89 -0.08 -0.72 0.81 5.75 -1.37 -0.54 115.11 119.84 1xlj h GLN 76 Ca 0.21 0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.71 1xlj h GLN 76 Cb 0.15 0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 1xlj h GLN 76 CO -0.02 -0.05 0.43 0.00 -2.65 0.00 0.00 178.83 176.54 1xlj h ALA 77 N 1.00 0.92 0.02 3.38 0.00 -1.12 0.45 119.26 123.91 1xlj h ALA 77 Ca 0.06 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1xlj h ALA 77 Cb 0.18 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1xlj h ALA 77 CO -0.15 0.40 -0.21 -0.07 0.00 0.00 0.00 179.25 179.22 1xlj h LEU 78 N 0.99 -0.62 0.43 0.00 3.38 -1.24 -1.82 115.31 116.42 1xlj h LEU 78 Ca 0.26 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.31 1xlj h LEU 78 Cb -0.02 0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 1xlj h LEU 78 CO -0.05 -0.28 -0.48 0.11 0.09 0.00 0.00 178.44 177.83 1xlj h LYS 79 N -0.35 -0.89 -0.96 1.13 1.79 -0.50 0.88 116.57 117.66 1xlj h LYS 79 Ca 0.05 0.06 0.21 0.00 -2.18 0.00 0.00 60.65 58.80 1xlj h LYS 79 Cb 0.42 0.20 -0.08 0.00 -1.58 0.00 0.00 32.23 31.19 1xlj h LYS 79 CO -0.18 -0.60 0.62 -0.44 -1.08 0.00 0.00 179.45 177.77 1xlj h ASP 80 N -0.93 0.53 0.00 0.86 5.19 0.17 -3.08 116.42 119.16 1xlj h ASP 80 Ca -0.05 0.06 -0.28 0.00 -0.62 0.00 0.00 57.03 56.15 1xlj h ASP 80 Cb 0.83 -0.03 -0.05 0.00 0.18 0.00 0.00 39.33 40.25 1xlj h ASP 80 CO -0.10 0.19 -2.21 0.35 -3.12 0.00 0.00 179.24 174.36 1xlj n THR 81 N -4.60 1.04 -0.16 0.35 -2.24 -0.71 -5.04 114.28 102.93 1xlj n THR 81 Ca 0.22 -0.73 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 1xlj n THR 81 Cb 0.69 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.51 1xlj n THR 81 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xlj n GLY 82 N 1.77 0.79 3.77 3.38 0.00 0.30 -5.02 105.19 110.19 1xlj n GLY 82 Ca -0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.36 1xlj n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xlj s LEU 83 N 0.00 4.40 0.63 0.99 1.43 -1.20 -4.97 118.68 119.97 1xlj s LEU 83 Ca 0.00 2.77 -0.02 0.00 -1.03 0.00 0.00 54.13 55.85 1xlj s LEU 83 Cb 0.00 -3.65 0.05 0.00 0.03 0.00 0.00 46.19 42.62 1xlj s LEU 83 CO 0.00 -0.61 0.89 -0.54 0.23 0.00 0.00 176.35 176.32 1xlj s LYS 84 N -1.85 2.32 -0.54 1.70 -0.14 -1.10 -4.77 119.74 115.36 1xlj s LYS 84 Ca 0.50 -0.61 0.04 0.00 -1.36 0.00 0.00 55.97 54.53 1xlj s LYS 84 Cb -0.41 -2.35 0.15 0.00 -1.68 0.00 0.00 37.83 33.54 1xlj s LYS 84 CO 0.55 -0.99 0.34 0.08 -0.76 0.00 0.00 175.35 174.57 1xlj s VAL 85 N -2.99 2.00 0.02 3.17 1.01 -1.26 -1.91 120.40 120.44 1xlj s VAL 85 Ca 0.59 -3.28 0.18 0.00 0.00 0.00 0.00 61.98 59.47 1xlj s VAL 85 Cb -0.10 -2.36 0.11 0.00 0.00 0.00 0.00 36.38 34.03 1xlj s VAL 85 CO 0.41 -0.95 1.61 -0.65 0.00 0.00 0.00 175.10 175.52 1xlj h PRO 86 N 6.12 0.00 -3.74 2.72 0.11 -1.85 -2.94 132.00 132.42 1xlj h PRO 86 Ca 0.06 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.01 1xlj h PRO 86 Cb 0.86 0.00 -0.21 0.00 0.11 0.00 0.00 31.00 31.76 1xlj h PRO 86 CO 0.59 0.43 -0.60 1.41 -0.21 0.00 0.00 178.00 179.62 1xlj s MET 87 N -3.30 0.39 0.02 1.05 -2.45 -1.26 -2.09 119.30 111.67 1xlj s MET 87 Ca 0.02 -0.50 0.02 0.00 -1.25 0.00 0.00 55.69 53.98 1xlj s MET 87 Cb 0.09 0.15 -0.02 0.00 1.25 0.00 0.00 34.83 36.31 1xlj s MET 87 CO 0.71 -0.08 -0.07 0.08 1.05 0.00 0.00 175.02 176.70 1xlj s VAL 88 N -1.40 0.54 0.15 10.11 1.01 -0.95 -3.65 120.40 126.20 1xlj s VAL 88 Ca -0.15 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.07 1xlj s VAL 88 Cb -0.09 -0.54 -0.03 0.00 0.00 0.00 0.00 36.38 35.72 1xlj s VAL 88 CO 0.00 -0.14 0.14 0.28 0.00 0.00 0.00 175.10 175.39 1xlj s THR 89 N -0.80 0.09 0.03 3.92 -1.32 -0.05 -2.22 115.64 115.29 1xlj s THR 89 Ca -0.04 -1.73 0.02 0.00 -1.21 0.00 0.00 61.69 58.74 1xlj s THR 89 Cb -0.06 -1.99 -0.04 0.00 -1.51 0.00 0.00 72.50 68.90 1xlj s THR 89 CO 0.00 -0.39 0.02 -0.89 -2.21 0.00 0.00 174.62 171.15 1xlj s THR 90 N -4.02 4.21 -0.51 5.08 2.01 -1.26 -1.84 115.64 119.31 1xlj s THR 90 Ca 0.22 -0.72 -0.23 0.00 0.31 0.00 0.00 61.69 61.27 1xlj s THR 90 Cb 0.06 -2.94 0.04 0.00 0.01 0.00 0.00 72.50 69.67 1xlj s THR 90 CO 0.02 0.27 0.84 0.21 -0.69 0.00 0.00 174.62 175.27 1xlj s ASN 91 N -1.89 6.35 -0.29 3.53 3.84 -1.26 -4.86 114.94 120.35 1xlj s ASN 91 Ca 0.23 -0.35 0.08 0.00 0.21 0.00 0.00 52.86 53.02 1xlj s ASN 91 Cb -0.12 -2.40 0.45 0.00 -0.55 0.00 0.00 41.25 38.64 1xlj s ASN 91 CO 0.14 -1.07 1.26 0.18 -2.79 0.00 0.00 177.10 174.82 1xlj n LEU 92 N 7.02 4.48 0.00 3.21 4.77 -1.26 -4.75 117.00 130.47 1xlj n LEU 92 Ca 0.01 -4.46 0.00 0.00 -0.03 0.00 0.00 56.01 51.52 1xlj n LEU 92 Cb 0.47 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1xlj n LEU 92 CO 0.61 1.86 0.00 2.22 -1.33 0.00 0.00 177.39 180.74 1xlj n PHE 93 N -0.85 0.00 0.06 -1.77 1.16 -1.26 -4.44 117.46 110.36 1xlj n PHE 93 Ca 0.38 0.00 -0.22 0.00 -1.87 0.00 0.00 57.45 55.74 1xlj n PHE 93 Cb 0.89 0.00 -0.15 0.00 -1.61 0.00 0.00 39.48 38.61 1xlj n PHE 93 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 1xlj h SER 94 N 0.00 0.55 -3.43 5.98 0.02 -1.93 -3.46 113.55 111.28 1xlj h SER 94 Ca 0.00 -0.92 -0.53 0.00 -0.84 0.00 0.00 61.79 59.51 1xlj h SER 94 Cb 0.00 -0.18 0.08 0.00 0.14 0.00 0.00 62.40 62.44 1xlj h SER 94 CO 0.00 1.58 0.82 -2.28 -1.14 0.00 0.00 176.83 175.82 1xlj s HIS 95 N -2.50 2.84 0.57 3.45 2.46 -1.26 -4.92 115.29 115.93 1xlj s HIS 95 Ca -0.15 0.93 0.32 0.00 0.47 0.00 0.00 55.06 56.64 1xlj s HIS 95 Cb 0.03 -3.96 1.44 0.00 -0.13 0.00 0.00 32.58 29.96 1xlj s HIS 95 CO 0.84 -3.13 1.78 -1.35 -2.47 0.00 0.00 174.74 170.41 1xlj h PRO 96 N 4.66 0.00 0.00 2.88 0.11 -2.03 -1.04 132.00 136.59 1xlj h PRO 96 Ca -0.47 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1xlj h PRO 96 Cb 1.22 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1xlj h PRO 96 CO 0.77 0.00 -0.05 -0.24 -0.21 0.00 0.00 178.00 178.26 1xlj h VAL 97 N 0.00 0.80 -0.45 3.15 3.04 -1.97 -2.43 116.25 118.40 1xlj h VAL 97 Ca 0.41 -0.20 -0.09 0.00 -1.01 0.00 0.00 66.70 65.81 1xlj h VAL 97 Cb 1.91 1.12 -0.05 0.00 -2.01 0.00 0.00 31.29 32.25 1xlj h VAL 97 CO -0.00 0.05 0.11 0.49 -1.01 0.00 0.00 177.57 177.21 1xlj n PHE 98 N -4.13 1.53 0.29 3.17 3.72 -0.39 -4.56 117.46 117.09 1xlj n PHE 98 Ca -0.03 -0.70 0.15 0.00 -0.05 0.00 0.00 57.45 56.82 1xlj n PHE 98 Cb 0.14 -0.46 0.86 0.00 -0.94 0.00 0.00 39.48 39.08 1xlj n PHE 98 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1xlj h LYS 99 N 2.12 0.00 -0.18 -1.08 2.10 -1.61 -2.08 116.57 115.84 1xlj h LYS 99 Ca 0.11 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.76 1xlj h LYS 99 Cb 1.67 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.00 1xlj h LYS 99 CO 0.43 0.05 0.00 -3.47 -2.00 0.00 0.00 179.45 174.46 1xlj n ASP 100 N -3.69 2.42 0.00 7.07 2.03 -1.26 -5.06 116.55 118.06 1xlj n ASP 100 Ca -0.02 -1.90 0.00 0.00 0.52 0.00 0.00 54.79 53.38 1xlj n ASP 100 Cb 0.15 -0.12 0.00 0.00 -0.72 0.00 0.00 41.12 40.43 1xlj n ASP 100 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xlj n GLY 101 N 0.14 1.22 0.00 0.27 0.00 -0.78 -3.81 105.19 102.22 1xlj n GLY 101 Ca 0.06 -2.26 0.00 0.00 0.00 0.00 0.00 46.02 43.83 1xlj n GLY 101 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xlj n GLY 102 N -1.11 -0.00 0.42 -0.02 0.00 -1.26 -4.30 105.19 98.91 1xlj n GLY 102 Ca 0.00 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.24 1xlj n GLY 102 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1xlj h PHE 103 N 0.00 0.48 -0.26 1.61 -1.00 -1.88 -2.36 116.94 113.53 1xlj h PHE 103 Ca 0.00 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.80 1xlj h PHE 103 Cb 0.00 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 39.42 1xlj h PHE 103 CO 0.00 0.10 0.00 0.25 -1.61 0.00 0.00 178.31 177.05 1xlj n THR 104 N -4.49 2.08 -1.66 -1.55 -2.24 -1.26 -4.44 114.28 100.72 1xlj n THR 104 Ca 0.21 -1.77 -0.41 0.00 -2.27 0.00 0.00 64.05 59.82 1xlj n THR 104 Cb 0.80 -0.14 0.02 0.00 -2.10 0.00 0.00 70.33 68.91 1xlj n THR 104 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1xlj n SER 105 N -0.41 1.88 0.12 3.42 2.88 -0.89 -4.80 113.62 115.82 1xlj n SER 105 Ca 0.20 1.04 0.01 0.00 -1.33 0.00 0.00 58.87 58.78 1xlj n SER 105 Cb 0.81 -1.44 0.33 0.00 -0.75 0.00 0.00 64.21 63.17 1xlj n SER 105 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 1xlj h ASN 106 N 1.65 0.19 -2.93 -3.46 2.35 -1.92 -3.41 115.58 108.04 1xlj h ASN 106 Ca -0.47 -0.06 -0.57 0.00 -0.55 0.00 0.00 56.30 54.66 1xlj h ASN 106 Cb 1.32 -0.05 -0.04 0.00 0.05 0.00 0.00 38.32 39.60 1xlj h ASN 106 CO 0.57 0.46 0.93 -0.62 -1.65 0.00 0.00 177.43 177.12 1xlj s ASP 107 N -6.89 6.88 0.31 5.81 -1.08 -1.26 -4.95 116.67 115.48 1xlj s ASP 107 Ca -0.05 1.63 -0.00 0.00 -0.52 0.00 0.00 52.55 53.61 1xlj s ASP 107 Cb 0.15 -2.54 0.48 0.00 -1.46 0.00 0.00 42.92 39.55 1xlj s ASP 107 CO 0.74 -0.83 1.91 -0.09 0.52 0.00 0.00 175.17 177.43 1xlj h ARG 108 N 8.48 0.88 -0.06 4.34 2.43 -2.00 -2.07 114.38 126.39 1xlj h ARG 108 Ca -0.27 -0.11 -0.09 0.00 -0.81 0.00 0.00 59.98 58.70 1xlj h ARG 108 Cb 1.11 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.47 1xlj h ARG 108 CO 0.98 0.68 -0.39 0.66 -1.51 0.00 0.00 179.97 180.39 1xlj h SER 109 N 0.88 0.12 0.39 -3.80 4.64 -1.95 -2.25 113.55 111.57 1xlj h SER 109 Ca 0.22 -0.04 -0.21 0.00 -0.47 0.00 0.00 61.79 61.28 1xlj h SER 109 Cb 0.08 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1xlj h SER 109 CO -0.03 0.50 -0.90 0.40 -0.87 0.00 0.00 176.83 175.92 1xlj h ILE 110 N 0.10 1.42 -0.74 0.95 2.04 -1.85 -2.84 117.51 116.59 1xlj h ILE 110 Ca 0.01 -2.46 -0.01 0.00 1.00 0.00 0.00 64.86 63.41 1xlj h ILE 110 Cb 0.73 2.40 -0.04 0.00 -0.74 0.00 0.00 36.82 39.17 1xlj h ILE 110 CO 0.05 0.73 0.44 0.03 0.00 0.00 0.00 178.15 179.40 1xlj h ARG 111 N 0.21 1.02 -0.57 2.37 3.08 -0.83 -0.27 114.38 119.39 1xlj h ARG 111 Ca -0.07 -0.10 -0.08 0.00 0.07 0.00 0.00 59.98 59.80 1xlj h ARG 111 Cb 1.53 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 31.35 1xlj h ARG 111 CO 0.15 0.73 0.02 0.00 -1.07 0.00 0.00 179.97 179.80 1xlj h ARG 112 N 1.02 0.96 -0.31 0.04 3.08 -1.43 -2.29 114.38 115.45 1xlj h ARG 112 Ca 0.27 -0.28 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 1xlj h ARG 112 Cb -0.01 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 1xlj h ARG 112 CO -0.05 0.94 0.10 0.35 -1.07 0.00 0.00 179.97 180.24 1xlj h PHE 113 N 0.89 0.51 -0.43 3.04 3.57 -1.22 0.15 116.94 123.45 1xlj h PHE 113 Ca 0.17 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 1xlj h PHE 113 Cb 0.49 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.07 1xlj h PHE 113 CO 0.03 0.51 0.22 0.00 -2.23 0.00 0.00 178.31 176.84 1xlj h ALA 114 N 0.93 0.55 -0.30 2.41 0.00 -0.93 0.79 119.26 122.71 1xlj h ALA 114 Ca 0.10 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1xlj h ALA 114 Cb 0.25 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1xlj h ALA 114 CO -0.00 0.10 0.12 1.25 0.00 0.00 0.00 179.25 180.71 1xlj h LEU 115 N 0.55 0.41 -0.92 0.00 5.85 -1.38 -2.14 115.31 117.68 1xlj h LEU 115 Ca 0.15 -0.17 -0.07 0.00 0.84 0.00 0.00 57.88 58.62 1xlj h LEU 115 Cb 0.10 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1xlj h LEU 115 CO -0.02 0.47 -0.01 0.00 -0.34 0.00 0.00 178.44 178.54 1xlj h ALA 116 N 0.96 1.10 -0.92 1.25 0.00 -0.63 -0.64 119.26 120.38 1xlj h ALA 116 Ca 0.10 -0.27 0.06 0.00 0.00 0.00 0.00 54.91 54.81 1xlj h ALA 116 Cb 0.19 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.72 1xlj h ALA 116 CO -0.01 0.57 0.58 -0.22 0.00 0.00 0.00 179.25 180.18 1xlj h LYS 117 N 0.73 1.04 -0.11 0.00 3.64 -0.62 -2.61 116.57 118.64 1xlj h LYS 117 Ca 0.14 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.43 1xlj h LYS 117 Cb 0.46 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1xlj h LYS 117 CO 0.02 0.69 -0.04 0.28 -2.27 0.00 0.00 179.45 178.12 1xlj h VAL 118 N 1.07 1.31 -0.41 2.00 2.07 -0.71 -2.82 116.25 118.75 1xlj h VAL 118 Ca 0.40 -1.03 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 1xlj h VAL 118 Cb 0.16 1.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1xlj h VAL 118 CO -0.17 0.29 0.19 -0.07 0.02 0.00 0.00 177.57 177.83 1xlj h LEU 119 N -0.12 0.55 -1.03 2.57 3.38 -1.00 -1.10 115.31 118.55 1xlj h LEU 119 Ca 0.03 -0.14 0.01 0.00 0.09 0.00 0.00 57.88 57.86 1xlj h LEU 119 Cb 0.48 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 1xlj h LEU 119 CO 0.01 0.53 0.63 0.45 0.09 0.00 0.00 178.44 180.16 1xlj h HIS 120 N 0.52 1.23 0.00 1.13 3.86 -1.52 -2.70 115.15 117.67 1xlj h HIS 120 Ca 0.14 0.02 -0.11 0.00 -1.16 0.00 0.00 60.37 59.27 1xlj h HIS 120 Cb 0.14 -0.41 -0.02 0.00 1.06 0.00 0.00 27.41 28.18 1xlj h HIS 120 CO -0.01 0.78 -0.50 -0.97 0.86 0.00 0.00 177.93 178.09 1xlj h ASN 121 N 1.31 0.00 -0.34 2.45 -1.24 -1.23 -2.69 115.58 113.84 1xlj h ASN 121 Ca 0.35 0.00 -0.03 0.00 0.71 0.00 0.00 56.30 57.33 1xlj h ASN 121 Cb -0.13 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 38.90 1xlj h ASN 121 CO -0.07 0.50 0.09 0.40 -1.29 0.00 0.00 177.43 177.06 1xlj h ILE 122 N 0.00 1.22 -0.08 2.57 2.04 -0.87 -0.41 117.51 121.98 1xlj h ILE 122 Ca -0.01 -0.72 0.04 0.00 1.00 0.00 0.00 64.86 65.17 1xlj h ILE 122 Cb 0.96 1.04 -0.05 0.00 -0.74 0.00 0.00 36.82 38.04 1xlj h ILE 122 CO 0.07 0.25 -0.20 0.44 0.00 0.00 0.00 178.15 178.71 1xlj h ASP 123 N 0.40 -0.59 -0.98 1.72 3.32 -1.38 -0.02 116.42 118.88 1xlj h ASP 123 Ca 0.11 0.10 0.02 0.00 0.02 0.00 0.00 57.03 57.28 1xlj h ASP 123 Cb 0.28 0.26 -0.05 0.00 0.22 0.00 0.00 39.33 40.04 1xlj h ASP 123 CO -0.00 -0.25 0.65 0.25 -1.72 0.00 0.00 179.24 178.17 1xlj h LEU 124 N -0.27 1.11 0.25 1.55 5.85 -1.37 -1.66 115.31 120.76 1xlj h LEU 124 Ca 0.08 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1xlj h LEU 124 Cb 0.39 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 1xlj h LEU 124 CO -0.24 0.78 -0.25 0.00 -0.34 0.00 0.00 178.44 178.39 1xlj h ALA 125 N 1.40 -0.52 -0.23 1.25 0.00 -0.05 -1.65 119.26 119.46 1xlj h ALA 125 Ca 0.37 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.24 1xlj h ALA 125 Cb -0.09 0.36 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1xlj h ALA 125 CO -0.10 -0.82 0.00 0.00 0.00 0.00 0.00 179.25 178.33 1xlj h ALA 126 N 0.12 0.20 -0.93 0.00 0.00 -0.69 -2.15 119.26 115.81 1xlj h ALA 126 Ca -0.01 0.06 0.17 0.00 0.00 0.00 0.00 54.91 55.14 1xlj h ALA 126 Cb 0.50 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 18.29 1xlj h ALA 126 CO -0.06 -0.42 0.52 1.49 0.00 0.00 0.00 179.25 180.78 1xlj h GLU 127 N 0.07 0.66 0.00 0.00 4.81 -0.94 -1.70 114.58 117.48 1xlj h GLU 127 Ca 0.11 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.21 1xlj h GLU 127 Cb 0.14 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 1xlj h GLU 127 CO -0.18 0.44 -0.42 0.52 -0.73 0.00 0.00 179.01 178.63 1xlj h MET 128 N 0.68 0.00 0.00 1.92 2.86 -0.71 -3.48 114.93 116.20 1xlj h MET 128 Ca 0.53 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.17 1xlj h MET 128 Cb 0.80 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.46 1xlj h MET 128 CO -0.38 0.42 0.00 0.41 1.06 0.00 0.00 176.91 178.42 1xlj n GLY 129 N 0.39 0.91 3.78 8.32 0.00 -0.64 -4.58 105.19 113.36 1xlj n GLY 129 Ca -0.00 -0.52 -0.37 0.00 0.00 0.00 0.00 46.02 45.13 1xlj n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xlj s ALA 130 N -2.00 3.00 -0.16 4.61 0.00 -1.11 -4.73 121.76 121.37 1xlj s ALA 130 Ca 0.00 0.81 0.20 0.00 0.00 0.00 0.00 51.96 52.97 1xlj s ALA 130 Cb 0.00 -3.33 -0.29 0.00 0.00 0.00 0.00 23.12 19.50 1xlj s ALA 130 CO 0.00 -0.45 0.49 0.39 0.00 0.00 0.00 175.76 176.19 1xlj n GLU 131 N -0.38 0.61 -4.89 0.00 -0.58 -0.89 -4.69 120.64 109.82 1xlj n GLU 131 Ca 0.07 -0.15 -0.27 0.00 -0.42 0.00 0.00 57.16 56.38 1xlj n GLU 131 Cb 0.49 -1.46 -0.16 0.00 -0.57 0.00 0.00 31.44 29.74 1xlj n GLU 131 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1xlj s THR 132 N -3.29 1.52 -0.28 2.62 2.01 -1.17 -1.81 115.64 115.25 1xlj s THR 132 Ca -0.05 -0.76 0.02 0.00 0.31 0.00 0.00 61.69 61.21 1xlj s THR 132 Cb 0.13 -1.31 0.06 0.00 0.01 0.00 0.00 72.50 71.39 1xlj s THR 132 CO 0.82 0.44 -0.07 0.12 -0.69 0.00 0.00 174.62 175.23 1xlj s PHE 133 N 0.08 3.33 0.09 4.92 5.36 0.11 -2.24 117.98 129.63 1xlj s PHE 133 Ca -0.05 -2.35 -0.14 0.00 -0.96 0.00 0.00 56.93 53.43 1xlj s PHE 133 Cb -0.12 -2.08 -0.06 0.00 -0.34 0.00 0.00 43.02 40.41 1xlj s PHE 133 CO 0.03 -0.88 0.48 0.08 -1.46 0.00 0.00 175.22 173.47 1xlj s VAL 134 N 1.10 4.94 -0.27 3.12 1.01 -0.94 -0.70 120.40 128.66 1xlj s VAL 134 Ca -0.06 0.77 -0.00 0.00 0.00 0.00 0.00 61.98 62.69 1xlj s VAL 134 Cb -0.20 -3.72 0.08 0.00 0.00 0.00 0.00 36.38 32.54 1xlj s VAL 134 CO -0.05 0.36 0.04 -0.04 0.00 0.00 0.00 175.10 175.41 1xlj s MET 135 N -1.67 1.04 -0.39 2.72 -1.94 -0.70 -4.12 119.30 114.25 1xlj s MET 135 Ca 0.32 -1.03 -0.10 0.00 -1.71 0.00 0.00 55.69 53.17 1xlj s MET 135 Cb -0.16 -2.32 0.05 0.00 2.01 0.00 0.00 34.83 34.41 1xlj s MET 135 CO 0.18 -0.81 0.23 -0.46 -0.01 0.00 0.00 175.02 174.14 1xlj s TRP 136 N 1.51 3.28 -1.39 -0.03 -0.00 -1.26 -1.84 118.94 119.21 1xlj s TRP 136 Ca 0.04 -1.22 -0.11 0.00 -0.00 0.00 0.00 56.10 54.81 1xlj s TRP 136 Cb -0.18 -2.65 0.08 0.00 -0.00 0.00 0.00 33.47 30.73 1xlj s TRP 136 CO -0.15 -0.74 2.18 0.41 -0.00 0.00 0.00 176.95 178.65 1xlj n GLY 137 N 4.96 4.61 0.23 5.86 0.00 -1.26 -4.78 105.19 114.82 1xlj n GLY 137 Ca -0.11 -1.82 0.10 0.00 0.00 0.00 0.00 46.02 44.18 1xlj n GLY 137 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1xlj h GLY 138 N 8.46 0.00 -1.84 -0.02 0.00 -1.91 -2.81 103.07 104.96 1xlj h GLY 138 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.87 1xlj h GLY 138 CO 1.74 0.00 0.00 0.54 0.00 0.00 0.00 176.54 178.82 1xlj n ARG 139 N -3.61 2.14 -2.65 4.80 5.12 -1.26 -3.86 116.66 117.33 1xlj n ARG 139 Ca -0.01 -1.87 -0.42 0.00 -1.93 0.00 0.00 57.85 53.61 1xlj n ARG 139 Cb 0.35 -1.43 -0.03 0.00 -1.16 0.00 0.00 32.46 30.18 1xlj n ARG 139 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1xlj s GLU 140 N -1.82 3.47 0.00 5.56 0.41 -1.06 -3.36 118.70 121.90 1xlj s GLU 140 Ca 0.27 0.12 0.00 0.00 -0.41 0.00 0.00 54.97 54.95 1xlj s GLU 140 Cb 0.19 -4.02 0.00 0.00 -1.78 0.00 0.00 34.13 28.52 1xlj s GLU 140 CO 0.28 -1.62 0.00 0.41 -0.49 0.00 0.00 175.26 173.84 1xlj n GLY 141 N 5.07 -0.56 3.67 -1.39 0.00 -1.26 -1.18 105.19 109.54 1xlj n GLY 141 Ca 0.07 -0.69 -0.09 0.00 0.00 0.00 0.00 46.02 45.31 1xlj n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xlj s SER 142 N -4.00 -0.38 -0.21 1.61 1.04 -0.80 -4.98 113.70 105.99 1xlj s SER 142 Ca 0.00 -0.34 0.16 0.00 0.48 0.00 0.00 55.95 56.26 1xlj s SER 142 Cb 0.00 0.66 -0.24 0.00 0.10 0.00 0.00 66.02 66.53 1xlj s SER 142 CO 0.00 -1.15 0.04 -0.62 0.98 0.00 0.00 173.24 172.49 1xlj n GLU 143 N -0.42 0.69 -4.77 4.02 4.71 -1.26 -2.02 120.64 121.59 1xlj n GLU 143 Ca -0.09 0.01 -0.32 0.00 -0.01 0.00 0.00 57.16 56.74 1xlj n GLU 143 Cb 0.62 -1.52 -0.13 0.00 -1.01 0.00 0.00 31.44 29.40 1xlj n GLU 143 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 1xlj s TYR 144 N -2.49 2.67 0.14 -0.32 2.02 -1.26 -4.92 117.35 113.18 1xlj s TYR 144 Ca -0.12 -0.18 0.25 0.00 -0.37 0.00 0.00 57.07 56.64 1xlj s TYR 144 Cb 0.06 -1.57 0.98 0.00 -0.40 0.00 0.00 41.96 41.03 1xlj s TYR 144 CO 0.81 0.23 1.85 -0.44 -1.57 0.00 0.00 175.55 176.42 1xlj h ASP 145 N 4.97 0.00 -0.20 2.29 3.32 -1.98 -3.20 116.42 121.62 1xlj h ASP 145 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1xlj h ASP 145 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 1xlj h ASP 145 CO 0.50 0.20 0.00 0.61 -1.72 0.00 0.00 179.24 178.83 1xlj n GLY 146 N 0.11 0.57 0.25 2.75 0.00 -1.26 -4.39 105.19 103.22 1xlj n GLY 146 Ca 0.00 -0.49 0.12 0.00 0.00 0.00 0.00 46.02 45.65 1xlj n GLY 146 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1xlj h SER 147 N 2.72 0.00 -4.69 1.61 0.02 -1.99 -3.45 113.55 107.77 1xlj h SER 147 Ca 0.00 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.71 1xlj h SER 147 Cb 0.60 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 62.96 1xlj h SER 147 CO 0.00 0.15 -0.71 -0.54 -1.14 0.00 0.00 176.83 174.59 1xlj s LYS 148 N -3.99 0.71 -0.38 3.45 -0.14 -1.26 -5.03 119.74 113.09 1xlj s LYS 148 Ca -0.02 -1.11 -0.14 0.00 -1.36 0.00 0.00 55.97 53.34 1xlj s LYS 148 Cb 0.12 -0.22 0.00 0.00 -1.68 0.00 0.00 37.83 36.05 1xlj s LYS 148 CO 0.60 0.01 0.30 0.34 -0.76 0.00 0.00 175.35 175.83 1xlj s ASP 149 N -2.47 6.11 0.32 2.83 -1.08 -1.26 -4.97 116.67 116.15 1xlj s ASP 149 Ca 0.03 -0.62 0.02 0.00 -0.52 0.00 0.00 52.55 51.46 1xlj s ASP 149 Cb -0.01 -2.16 0.54 0.00 -1.46 0.00 0.00 42.92 39.83 1xlj s ASP 149 CO -0.03 -0.37 1.89 -0.07 0.52 0.00 0.00 175.17 177.11 1xlj h LEU 150 N 8.64 0.65 -0.26 -1.34 3.38 -1.99 -0.03 115.31 124.36 1xlj h LEU 150 Ca -0.29 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.52 1xlj h LEU 150 Cb 1.14 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1xlj h LEU 150 CO 0.70 0.63 -0.11 0.00 0.09 0.00 0.00 178.44 179.74 1xlj h ALA 151 N 1.47 0.36 -0.39 1.53 0.00 -2.00 -2.99 119.26 117.24 1xlj h ALA 151 Ca 0.16 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 1xlj h ALA 151 Cb 0.21 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1xlj h ALA 151 CO -0.01 0.22 -0.12 0.00 0.00 0.00 0.00 179.25 179.35 1xlj h ALA 152 N 0.74 1.06 -0.57 0.00 0.00 -1.92 -1.20 119.26 117.37 1xlj h ALA 152 Ca 0.06 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1xlj h ALA 152 Cb 0.62 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1xlj h ALA 152 CO 0.04 0.57 0.37 0.00 0.00 0.00 0.00 179.25 180.23 1xlj h ALA 153 N 1.24 0.72 -0.21 0.00 0.00 -0.97 0.93 119.26 120.97 1xlj h ALA 153 Ca 0.11 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.81 1xlj h ALA 153 Cb 0.57 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1xlj h ALA 153 CO 0.04 0.17 -0.53 -0.07 0.00 0.00 0.00 179.25 178.86 1xlj h LEU 154 N 0.77 0.67 -0.26 0.00 3.38 -1.35 -0.95 115.31 117.56 1xlj h LEU 154 Ca 0.21 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 1xlj h LEU 154 Cb -0.07 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1xlj h LEU 154 CO -0.04 1.07 0.13 0.44 0.09 0.00 0.00 178.44 180.13 1xlj h ASP 155 N 0.47 0.34 -0.60 -0.43 3.32 -0.85 0.34 116.42 119.01 1xlj h ASP 155 Ca 0.01 -0.12 -0.06 0.00 0.02 0.00 0.00 57.03 56.89 1xlj h ASP 155 Cb 1.08 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 40.51 1xlj h ASP 155 CO 0.10 0.36 0.15 0.03 -1.72 0.00 0.00 179.24 178.17 1xlj h ARG 156 N 0.30 0.99 0.07 3.56 2.47 -0.70 -0.19 114.38 120.88 1xlj h ARG 156 Ca 0.09 -0.22 -0.00 0.00 -1.26 0.00 0.00 59.98 58.59 1xlj h ARG 156 Cb 0.11 -0.14 0.00 0.00 -1.65 0.00 0.00 29.97 28.29 1xlj h ARG 156 CO -0.01 0.88 -0.03 1.98 0.56 0.00 0.00 179.97 183.34 1xlj h MET 157 N 0.94 -0.09 -0.68 0.04 4.05 -0.89 -2.06 114.93 116.23 1xlj h MET 157 Ca 0.20 0.01 0.05 0.00 -0.28 0.00 0.00 59.70 59.68 1xlj h MET 157 Cb 0.34 0.02 -0.05 0.00 -0.80 0.00 0.00 31.60 31.10 1xlj h MET 157 CO 0.00 -0.06 0.39 -0.09 0.23 0.00 0.00 176.91 177.38 1xlj h ARG 158 N -0.10 0.71 -0.40 0.39 2.43 -0.64 -1.94 114.38 114.83 1xlj h ARG 158 Ca -0.01 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.09 1xlj h ARG 158 Cb 0.07 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 1xlj h ARG 158 CO 0.02 0.47 0.15 1.49 -1.51 0.00 0.00 179.97 180.59 1xlj h GLU 159 N 0.73 0.60 -0.25 0.20 4.81 -0.83 0.12 114.58 119.96 1xlj h GLU 159 Ca 0.30 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.39 1xlj h GLU 159 Cb 0.15 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1xlj h GLU 159 CO -0.16 0.57 0.06 0.78 -0.73 0.00 0.00 179.01 179.53 1xlj h GLY 160 N 0.50 0.42 0.99 1.92 0.00 -0.98 -0.11 103.07 105.81 1xlj h GLY 160 Ca 0.13 -0.27 -0.02 0.00 0.00 0.00 0.00 47.33 47.17 1xlj h GLY 160 CO -0.01 0.25 0.27 -2.08 0.00 0.00 0.00 176.54 174.97 1xlj h VAL 161 N 0.23 1.21 -0.02 4.60 2.07 -1.29 -1.70 116.25 121.35 1xlj h VAL 161 Ca 0.08 -0.58 -0.12 0.00 0.82 0.00 0.00 66.70 66.90 1xlj h VAL 161 Cb 0.28 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1xlj h VAL 161 CO 0.00 0.23 -0.55 0.44 0.02 0.00 0.00 177.57 177.72 1xlj h ASP 162 N 0.77 0.07 0.16 0.57 3.32 -0.95 -1.23 116.42 119.13 1xlj h ASP 162 Ca 0.20 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1xlj h ASP 162 Cb 0.12 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.65 1xlj h ASP 162 CO -0.02 0.60 -0.08 0.74 -1.72 0.00 0.00 179.24 178.76 1xlj h THR 163 N 0.05 0.97 -0.98 0.35 2.02 -0.71 -2.16 112.91 112.45 1xlj h THR 163 Ca -0.00 -0.74 0.12 0.00 0.77 0.00 0.00 66.41 66.56 1xlj h THR 163 Cb 0.98 1.41 -0.08 0.00 -1.74 0.00 0.00 68.15 68.72 1xlj h THR 163 CO 0.07 0.17 0.62 0.00 0.37 0.00 0.00 175.52 176.75 1xlj h ALA 164 N 0.17 1.58 -0.14 6.16 0.00 -1.14 -1.90 119.26 123.99 1xlj h ALA 164 Ca -0.02 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1xlj h ALA 164 Cb 0.44 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1xlj h ALA 164 CO 0.04 0.18 -0.06 0.00 0.00 0.00 0.00 179.25 179.41 1xlj h ALA 165 N 1.55 0.20 -0.83 0.00 0.00 -1.21 -2.10 119.26 116.88 1xlj h ALA 165 Ca 0.49 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 1xlj h ALA 165 Cb 0.53 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1xlj h ALA 165 CO -0.25 -0.02 0.38 0.78 0.00 0.00 0.00 179.25 180.14 1xlj h GLY 166 N -0.03 1.29 0.93 0.00 0.00 -1.13 -0.04 103.07 104.09 1xlj h GLY 166 Ca 0.03 -0.66 -0.01 0.00 0.00 0.00 0.00 47.33 46.70 1xlj h GLY 166 CO 0.02 0.62 0.13 -1.82 0.00 0.00 0.00 176.54 175.49 1xlj h TYR 167 N 1.19 0.36 0.21 5.60 3.20 -1.28 0.21 116.97 126.45 1xlj h TYR 167 Ca 0.28 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.15 1xlj h TYR 167 Cb 0.14 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.27 1xlj h TYR 167 CO 0.02 0.33 -0.27 0.82 -1.64 0.00 0.00 178.16 177.42 1xlj h ILE 168 N 0.28 0.42 0.15 1.81 2.04 -0.64 -0.23 117.51 121.34 1xlj h ILE 168 Ca 0.09 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.96 1xlj h ILE 168 Cb 0.11 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 36.58 1xlj h ILE 168 CO -0.01 0.00 -0.25 0.11 0.00 0.00 0.00 178.15 178.00 1xlj h LYS 169 N -0.54 -0.45 -0.32 2.37 1.57 -0.90 -1.26 116.57 117.04 1xlj h LYS 169 Ca 0.01 0.03 0.07 0.00 -1.87 0.00 0.00 60.65 58.89 1xlj h LYS 169 Cb 0.52 0.10 -0.08 0.00 0.08 0.00 0.00 32.23 32.85 1xlj h LYS 169 CO -0.09 -0.30 -0.34 -0.44 -0.57 0.00 0.00 179.45 177.70 1xlj h ASP 170 N -0.47 -1.11 0.39 0.86 3.32 -0.40 -1.49 116.42 117.52 1xlj h ASP 170 Ca 0.02 0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1xlj h ASP 170 Cb 0.48 0.50 0.00 0.00 0.22 0.00 0.00 39.33 40.53 1xlj h ASP 170 CO -0.12 -0.34 0.00 0.29 -1.72 0.00 0.00 179.24 177.35 1xlj n LYS 171 N -5.42 0.33 -3.12 3.56 4.76 -0.12 -4.89 118.16 113.27 1xlj n LYS 171 Ca -0.00 0.07 -0.18 0.00 -2.87 0.00 0.00 58.31 55.33 1xlj n LYS 171 Cb 0.34 -1.50 0.05 0.00 -1.84 0.00 0.00 35.03 32.07 1xlj n LYS 171 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xlj n GLY 172 N 0.56 -0.20 3.80 0.72 0.00 -0.56 -4.98 105.19 104.53 1xlj n GLY 172 Ca 0.11 -0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 1xlj n GLY 172 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xlj s TYR 173 N -3.15 3.03 -1.10 1.61 2.02 -0.57 -4.95 117.35 114.24 1xlj s TYR 173 Ca 0.36 1.55 -0.04 0.00 -0.37 0.00 0.00 57.07 58.56 1xlj s TYR 173 Cb -0.16 -3.03 0.29 0.00 -0.40 0.00 0.00 41.96 38.67 1xlj s TYR 173 CO 0.44 -0.87 1.56 -1.71 -1.57 0.00 0.00 175.55 173.40 1xlj n ASN 174 N -1.32 6.39 -3.96 2.29 5.15 -1.26 -4.77 115.26 117.78 1xlj n ASN 174 Ca 0.09 -3.40 -0.11 0.00 -0.60 0.00 0.00 54.58 50.55 1xlj n ASN 174 Cb 0.53 -1.29 -0.12 0.00 -0.53 0.00 0.00 39.78 38.37 1xlj n ASN 174 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1xlj s LEU 175 N -2.64 2.15 0.06 1.20 1.43 -1.26 -4.47 118.68 115.15 1xlj s LEU 175 Ca 0.33 -0.32 0.08 0.00 -1.03 0.00 0.00 54.13 53.19 1xlj s LEU 175 Cb 0.07 -0.00 -0.03 0.00 0.03 0.00 0.00 46.19 46.26 1xlj s LEU 175 CO 0.08 -0.16 -0.23 -0.13 0.23 0.00 0.00 176.35 176.14 1xlj s ARG 176 N -0.91 1.48 -0.08 1.70 0.52 -0.75 -4.97 118.95 115.94 1xlj s ARG 176 Ca -0.09 -1.04 -0.12 0.00 -0.52 0.00 0.00 55.73 53.97 1xlj s ARG 176 Cb -0.06 -1.65 -0.05 0.00 0.52 0.00 0.00 34.95 33.71 1xlj s ARG 176 CO -0.00 0.42 0.29 0.42 0.02 0.00 0.00 175.30 176.44 1xlj s ILE 177 N -0.85 5.26 -0.16 1.52 1.01 -0.59 0.09 121.20 127.48 1xlj s ILE 177 Ca 0.09 0.55 -0.00 0.00 0.00 0.00 0.00 60.65 61.28 1xlj s ILE 177 Cb -0.09 -3.58 0.04 0.00 0.01 0.00 0.00 42.46 38.83 1xlj s ILE 177 CO 0.02 0.55 -0.06 0.00 0.00 0.00 0.00 174.94 175.46 1xlj s ALA 178 N -0.72 1.49 0.24 9.38 0.00 0.12 -0.32 121.76 131.95 1xlj s ALA 178 Ca 0.19 -0.82 -0.27 0.00 0.00 0.00 0.00 51.96 51.06 1xlj s ALA 178 Cb -0.14 -1.11 -0.09 0.00 0.00 0.00 0.00 23.12 21.78 1xlj s ALA 178 CO 0.08 -0.75 0.88 -0.51 0.00 0.00 0.00 175.76 175.46 1xlj s LEU 179 N 1.63 4.53 -0.30 0.00 1.43 -0.53 -1.72 118.68 123.72 1xlj s LEU 179 Ca 0.01 1.80 0.02 0.00 -1.03 0.00 0.00 54.13 54.92 1xlj s LEU 179 Cb -0.15 -3.63 0.07 0.00 0.03 0.00 0.00 46.19 42.51 1xlj s LEU 179 CO -0.08 0.10 -0.03 -0.70 0.23 0.00 0.00 176.35 175.88 1xlj s GLU 180 N -1.47 2.12 0.46 1.70 2.12 -0.76 -0.37 118.70 122.50 1xlj s GLU 180 Ca 0.42 -1.47 -0.22 0.00 0.36 0.00 0.00 54.97 54.07 1xlj s GLU 180 Cb -0.23 -3.07 -0.08 0.00 0.26 0.00 0.00 34.13 31.01 1xlj s GLU 180 CO 0.27 -0.69 1.08 -2.14 -0.54 0.00 0.00 175.26 173.24 1xlj s PRO 181 N 1.10 3.85 -0.28 4.30 0.02 -1.26 -4.31 135.00 138.43 1xlj s PRO 181 Ca -0.03 1.51 -0.18 0.00 0.02 0.00 0.00 61.00 62.33 1xlj s PRO 181 Cb -0.20 -2.28 0.08 0.00 0.02 0.00 0.00 34.50 32.12 1xlj s PRO 181 CO -0.05 -0.41 0.69 0.21 -0.33 0.00 0.00 177.00 177.11 1xlj s LYS 182 N -2.91 0.73 0.13 5.54 2.20 -1.22 -4.69 119.74 119.52 1xlj s LYS 182 Ca 0.64 1.18 -0.08 0.00 -0.36 0.00 0.00 55.97 57.36 1xlj s LYS 182 Cb -0.21 0.19 -0.08 0.00 -1.51 0.00 0.00 37.83 36.22 1xlj s LYS 182 CO 0.26 -0.14 1.34 -1.00 -0.36 0.00 0.00 175.35 175.44 1xlj h PRO 183 N 6.60 0.60 -2.80 4.03 0.14 -1.74 -3.36 132.00 135.47 1xlj h PRO 183 Ca -0.30 -0.52 0.06 0.00 0.14 0.00 0.00 66.00 65.37 1xlj h PRO 183 Cb 1.22 0.12 -0.01 0.00 0.14 0.00 0.00 31.00 32.47 1xlj h PRO 183 CO 0.14 1.15 0.42 0.54 0.14 0.00 0.00 178.00 180.39 1xlj s ASN 184 N -7.08 0.02 -0.04 1.44 4.22 -1.26 -2.04 114.94 110.21 1xlj s ASN 184 Ca -0.08 -0.97 -0.03 0.00 -2.14 0.00 0.00 52.86 49.64 1xlj s ASN 184 Cb 0.09 0.70 0.01 0.00 1.28 0.00 0.00 41.25 43.33 1xlj s ASN 184 CO 0.88 -1.40 0.07 1.21 -2.04 0.00 0.00 177.10 175.82 1xlj n GLU 185 N -0.62 -4.22 0.00 3.55 0.00 -1.26 -4.79 120.64 113.30 1xlj n GLU 185 Ca -0.06 3.18 0.14 0.00 0.00 0.00 0.00 57.16 60.41 1xlj n GLU 185 Cb 0.60 -4.16 0.59 0.00 0.00 0.00 0.00 31.44 28.46 1xlj n GLU 185 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 1xlj n PRO 186 N 1.51 0.24 -2.96 5.31 -0.04 -1.26 -5.02 135.00 132.78 1xlj n PRO 186 Ca -0.11 -0.05 -0.26 0.00 -0.04 0.00 0.00 63.50 63.04 1xlj n PRO 186 Cb 0.17 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.13 1xlj n PRO 186 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1xlj s ARG 187 N -2.80 3.49 0.18 0.54 1.81 -1.25 -5.00 118.95 115.93 1xlj s ARG 187 Ca 0.20 -0.05 -0.11 0.00 -1.72 0.00 0.00 55.73 54.04 1xlj s ARG 187 Cb 0.19 -2.50 0.10 0.00 -0.45 0.00 0.00 34.95 32.28 1xlj s ARG 187 CO 0.53 -0.06 1.75 0.78 -0.68 0.00 0.00 175.30 177.62 1xlj h GLY 188 N 0.45 1.02 -6.97 -3.53 0.00 -1.90 -3.42 103.07 88.72 1xlj h GLY 188 Ca -0.48 -0.54 -0.43 0.00 0.00 0.00 0.00 47.33 45.88 1xlj h GLY 188 CO 0.61 0.51 -0.77 0.99 0.00 0.00 0.00 176.54 177.89 1xlj s ASP 189 N -6.12 1.49 -0.04 0.19 1.01 -0.85 -4.69 116.67 107.66 1xlj s ASP 189 Ca -0.13 -0.08 -0.04 0.00 0.71 0.00 0.00 52.55 53.01 1xlj s ASP 189 Cb 0.13 -0.42 -0.04 0.00 1.01 0.00 0.00 42.92 43.60 1xlj s ASP 189 CO 0.80 -0.18 0.18 -0.63 0.21 0.00 0.00 175.17 175.55 1xlj s ILE 190 N 1.88 5.44 0.33 0.77 1.01 -0.86 -1.91 121.20 127.86 1xlj s ILE 190 Ca 0.03 -0.02 -0.27 0.00 0.00 0.00 0.00 60.65 60.40 1xlj s ILE 190 Cb -0.12 -3.51 -0.09 0.00 0.01 0.00 0.00 42.46 38.75 1xlj s ILE 190 CO -0.05 0.41 1.08 -0.36 0.00 0.00 0.00 174.94 176.02 1xlj s PHE 191 N -1.24 3.44 -0.91 3.97 0.08 -0.33 -3.69 117.98 119.31 1xlj s PHE 191 Ca 0.24 1.68 -0.05 0.00 0.12 0.00 0.00 56.93 58.92 1xlj s PHE 191 Cb -0.13 -3.22 -0.06 0.00 -0.57 0.00 0.00 43.02 39.05 1xlj s PHE 191 CO 0.14 -0.58 0.80 1.28 -0.10 0.00 0.00 175.22 176.76 1xlj n LEU 192 N 0.64 -5.18 0.19 -0.37 4.77 -1.26 -4.80 117.00 110.97 1xlj n LEU 192 Ca 0.02 -0.61 0.14 0.00 -0.03 0.00 0.00 56.01 55.52 1xlj n LEU 192 Cb 0.47 -2.86 0.54 0.00 -2.33 0.00 0.00 43.42 39.24 1xlj n LEU 192 CO 0.50 0.08 0.91 1.55 -1.33 0.00 0.00 177.39 179.09 1xlj h PRO 193 N -0.92 0.00 -4.60 3.23 0.13 -1.71 -3.23 132.00 124.89 1xlj h PRO 193 Ca -0.52 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.27 1xlj h PRO 193 Cb 1.27 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.27 1xlj h PRO 193 CO 0.38 0.00 -0.47 0.95 -0.23 0.00 0.00 178.00 178.63 1xlj s THR 194 N -3.42 0.00 0.13 1.56 -4.23 -1.26 -2.50 115.64 105.92 1xlj s THR 194 Ca 0.04 -1.91 -0.21 0.00 -1.18 0.00 0.00 61.69 58.43 1xlj s THR 194 Cb 0.09 -2.50 -0.03 0.00 1.34 0.00 0.00 72.50 71.40 1xlj s THR 194 CO 0.48 0.00 1.70 0.58 -0.54 0.00 0.00 174.62 176.83 1xlj h VAL 195 N 2.32 0.76 -0.37 2.29 2.07 -1.93 -1.91 116.25 119.47 1xlj h VAL 195 Ca -0.30 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.29 1xlj h VAL 195 Cb 1.24 0.76 -0.06 0.00 -1.52 0.00 0.00 31.29 31.70 1xlj h VAL 195 CO 0.43 0.00 -0.02 1.23 0.02 0.00 0.00 177.57 179.23 1xlj h GLY 196 N -0.05 0.35 0.68 2.17 0.00 -1.97 0.11 103.07 104.36 1xlj h GLY 196 Ca 0.09 0.06 0.03 0.00 0.00 0.00 0.00 47.33 47.51 1xlj h GLY 196 CO -0.21 -0.10 -0.07 0.45 0.00 0.00 0.00 176.54 176.61 1xlj h HIS 197 N 0.08 -0.17 -0.42 5.60 -0.00 -1.89 0.28 115.15 118.63 1xlj h HIS 197 Ca 0.18 0.01 0.03 0.00 -0.00 0.00 0.00 60.37 60.59 1xlj h HIS 197 Cb 0.26 0.09 -0.03 0.00 -0.00 0.00 0.00 27.41 27.73 1xlj h HIS 197 CO -0.27 -0.11 0.22 0.78 -0.00 0.00 0.00 177.93 178.55 1xlj h GLY 198 N -0.08 0.58 0.94 2.45 0.00 -1.00 -0.83 103.07 105.12 1xlj h GLY 198 Ca 0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 47.33 47.22 1xlj h GLY 198 CO -0.15 0.13 0.16 1.41 0.00 0.00 0.00 176.54 178.08 1xlj h LEU 199 N 0.45 0.47 0.37 3.11 3.38 -0.36 -2.22 115.31 120.50 1xlj h LEU 199 Ca 0.17 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1xlj h LEU 199 Cb 0.05 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1xlj h LEU 199 CO -0.10 0.48 -0.24 0.00 0.09 0.00 0.00 178.44 178.66 1xlj h ALA 200 N 1.01 -0.59 -0.60 1.53 0.00 -0.26 -3.06 119.26 117.29 1xlj h ALA 200 Ca 0.12 -0.11 0.12 0.00 0.00 0.00 0.00 54.91 55.04 1xlj h ALA 200 Cb 0.15 0.31 -0.10 0.00 0.00 0.00 0.00 17.79 18.15 1xlj h ALA 200 CO -0.01 -0.85 0.02 0.35 0.00 0.00 0.00 179.25 178.76 1xlj h PHE 201 N -0.60 -0.01 -0.64 0.00 3.57 -1.12 -1.90 116.94 116.25 1xlj h PHE 201 Ca -0.04 0.04 0.15 0.00 3.53 0.00 0.00 57.97 61.65 1xlj h PHE 201 Cb 0.50 0.10 -0.04 0.00 2.79 0.00 0.00 35.95 39.30 1xlj h PHE 201 CO -0.11 -0.14 0.44 0.82 -2.23 0.00 0.00 178.31 177.09 1xlj h ILE 202 N 0.13 0.78 0.00 1.41 2.04 -1.29 -2.00 117.51 118.58 1xlj h ILE 202 Ca 0.31 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 66.09 1xlj h ILE 202 Cb 0.49 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 1xlj h ILE 202 CO -0.50 0.04 0.00 -0.62 0.00 0.00 0.00 178.15 177.07 1xlj n GLU 203 N -4.43 0.16 0.00 2.37 -0.58 -0.71 -2.54 120.64 114.91 1xlj n GLU 203 Ca 0.12 0.51 0.12 0.00 -0.42 0.00 0.00 57.16 57.48 1xlj n GLU 203 Cb 0.55 -1.89 0.07 0.00 -0.57 0.00 0.00 31.44 29.60 1xlj n GLU 203 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1xlj n GLN 204 N -2.22 1.91 -2.83 3.49 1.13 -0.75 -4.97 117.38 113.14 1xlj n GLN 204 Ca 0.01 -1.57 -0.30 0.00 -1.94 0.00 0.00 57.00 53.19 1xlj n GLN 204 Cb 0.14 -1.47 -0.03 0.00 0.11 0.00 0.00 30.24 28.99 1xlj n GLN 204 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1xlj s LEU 205 N -2.17 3.82 -0.08 1.08 1.43 -1.05 -5.00 118.68 116.70 1xlj s LEU 205 Ca 0.25 1.16 -0.27 0.00 -1.03 0.00 0.00 54.13 54.25 1xlj s LEU 205 Cb 0.19 -4.05 -0.24 0.00 0.03 0.00 0.00 46.19 42.12 1xlj s LEU 205 CO 0.40 -0.41 0.96 -0.08 0.23 0.00 0.00 176.35 177.45 1xlj h GLU 206 N 1.26 0.06 -1.06 1.70 4.81 -1.93 -3.32 114.58 116.10 1xlj h GLU 206 Ca -0.47 -0.07 -0.49 0.00 -0.13 0.00 0.00 59.36 58.20 1xlj h GLU 206 Cb 1.19 0.02 -0.26 0.00 0.63 0.00 0.00 28.75 30.33 1xlj h GLU 206 CO 0.64 0.87 0.63 0.72 -0.73 0.00 0.00 179.01 181.14 1xlj n HIS 207 N -4.62 2.66 -0.40 0.92 8.25 -1.26 -4.77 115.22 116.00 1xlj n HIS 207 Ca -0.10 -2.06 0.34 0.00 -0.26 0.00 0.00 57.72 55.64 1xlj n HIS 207 Cb 0.45 -1.02 0.65 0.00 1.12 0.00 0.00 29.99 31.19 1xlj n HIS 207 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1xlj h GLY 208 N 1.73 0.78 0.51 -1.41 0.00 -1.79 -2.82 103.07 100.06 1xlj h GLY 208 Ca 0.53 -0.10 0.16 0.00 0.00 0.00 0.00 47.33 47.92 1xlj h GLY 208 CO 1.10 -0.17 0.56 1.29 0.00 0.00 0.00 176.54 179.33 1xlj h ASP 209 N 0.15 0.55 -0.40 0.19 2.03 -1.91 -1.78 116.42 115.24 1xlj h ASP 209 Ca 0.70 0.04 0.00 0.00 -0.73 0.00 0.00 57.03 57.03 1xlj h ASP 209 Cb 2.30 -0.07 0.00 0.00 -0.83 0.00 0.00 39.33 40.73 1xlj h ASP 209 CO -0.23 0.27 0.00 2.30 -1.03 0.00 0.00 179.24 180.55 1xlj n ILE 210 N -4.54 1.91 -4.48 4.15 -5.35 -1.07 -4.97 119.36 105.01 1xlj n ILE 210 Ca 0.17 -1.46 -0.34 0.00 -0.27 0.00 0.00 62.75 60.86 1xlj n ILE 210 Cb 0.53 0.02 -0.14 0.00 -1.74 0.00 0.00 39.64 38.31 1xlj n ILE 210 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1xlj s VAL 211 N -2.14 3.16 0.00 7.28 1.01 -0.67 -1.54 120.40 127.50 1xlj s VAL 211 Ca 0.41 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.78 1xlj s VAL 211 Cb 0.29 -2.36 0.00 0.00 0.00 0.00 0.00 36.38 34.31 1xlj s VAL 211 CO 0.15 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.35 1xlj n GLY 212 N 3.92 5.29 3.57 4.51 0.00 0.56 -4.97 105.19 118.06 1xlj n GLY 212 Ca -0.18 -1.43 -0.25 0.00 0.00 0.00 0.00 46.02 44.15 1xlj n GLY 212 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xlj s LEU 213 N 0.00 2.82 -0.40 0.99 1.43 0.22 -1.46 118.68 122.28 1xlj s LEU 213 Ca 0.00 -1.08 0.06 0.00 -1.03 0.00 0.00 54.13 52.08 1xlj s LEU 213 Cb 0.00 -1.16 0.20 0.00 0.03 0.00 0.00 46.19 45.26 1xlj s LEU 213 CO 0.00 -0.17 0.42 -3.20 0.23 0.00 0.00 176.35 173.63 1xlj n ASN 214 N -0.83 -0.20 -4.75 2.29 5.15 0.51 -2.51 115.26 114.92 1xlj n ASN 214 Ca -0.05 -2.51 -0.35 0.00 -0.60 0.00 0.00 54.58 51.08 1xlj n ASN 214 Cb 0.62 -0.59 0.05 0.00 -0.53 0.00 0.00 39.78 39.34 1xlj n ASN 214 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 1xlj s PRO 215 N -0.48 2.73 -0.07 1.20 0.02 -1.26 -4.33 135.00 132.81 1xlj s PRO 215 Ca 0.34 1.67 0.00 0.00 0.02 0.00 0.00 61.00 63.03 1xlj s PRO 215 Cb 0.10 -1.92 0.02 0.00 0.02 0.00 0.00 34.50 32.72 1xlj s PRO 215 CO -0.16 -1.36 -0.06 -2.00 -0.33 0.00 0.00 177.00 173.09 1xlj s GLU 216 N -3.69 1.18 0.03 5.54 2.12 -1.26 -2.05 118.70 120.57 1xlj s GLU 216 Ca 0.73 -0.18 -0.06 0.00 0.36 0.00 0.00 54.97 55.83 1xlj s GLU 216 Cb -0.27 -1.20 -0.01 0.00 0.26 0.00 0.00 34.13 32.91 1xlj s GLU 216 CO 0.38 -0.15 0.80 2.41 -0.54 0.00 0.00 175.26 178.16 1xlj n THR 217 N 4.44 -0.12 -0.34 -1.70 -1.04 -1.05 -1.06 114.28 113.41 1xlj n THR 217 Ca -0.18 1.22 0.11 0.00 -2.04 0.00 0.00 64.05 63.17 1xlj n THR 217 Cb 0.51 -1.59 0.31 0.00 -1.82 0.00 0.00 70.33 67.73 1xlj n THR 217 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1xlj h GLY 218 N 0.00 1.63 0.88 3.41 0.00 -1.86 -2.61 103.07 104.52 1xlj h GLY 218 Ca 0.03 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 46.98 1xlj h GLY 218 CO -0.17 0.04 0.05 0.45 0.00 0.00 0.00 176.54 176.91 1xlj h HIS 219 N 0.83 0.15 -0.14 5.60 3.86 -1.45 -2.10 115.15 121.90 1xlj h HIS 219 Ca 0.53 -0.01 -0.10 0.00 -1.16 0.00 0.00 60.37 59.63 1xlj h HIS 219 Cb 0.75 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 29.16 1xlj h HIS 219 CO -0.00 0.24 -0.37 0.93 0.86 0.00 0.00 177.93 179.59 1xlj h GLU 220 N 0.02 0.30 0.00 2.45 4.39 -1.09 -2.90 114.58 117.75 1xlj h GLU 220 Ca 0.03 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.60 1xlj h GLU 220 Cb 0.15 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 1xlj h GLU 220 CO -0.00 0.63 0.00 1.96 -1.16 0.00 0.00 179.01 180.44 1xlj h GLN 221 N 0.26 0.00 0.00 2.33 4.20 -1.27 -2.23 115.11 118.40 1xlj h GLN 221 Ca 0.03 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 1xlj h GLN 221 Cb 0.77 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.55 1xlj h GLN 221 CO 0.06 0.00 -0.06 0.52 -0.67 0.00 0.00 178.83 178.68 1xlj h MET 222 N 0.00 0.00 -0.02 1.46 2.86 -1.16 -2.55 114.93 115.51 1xlj h MET 222 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1xlj h MET 222 Cb 0.25 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.91 1xlj h MET 222 CO 0.00 0.06 -0.17 0.00 1.06 0.00 0.00 176.91 177.87 1xlj n ALA 223 N -2.13 2.83 -1.09 6.32 0.00 -0.86 -4.74 120.51 120.85 1xlj n ALA 223 Ca 0.01 -0.63 -0.03 0.00 0.00 0.00 0.00 53.44 52.79 1xlj n ALA 223 Cb 0.37 -0.68 -0.01 0.00 0.00 0.00 0.00 19.45 19.12 1xlj n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xlj n GLY 224 N 1.20 0.62 3.92 0.00 0.00 -0.96 -5.03 105.19 104.93 1xlj n GLY 224 Ca 0.10 -0.89 -0.27 0.00 0.00 0.00 0.00 46.02 44.97 1xlj n GLY 224 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xlj s LEU 225 N -0.70 3.17 -0.37 0.99 1.43 -1.09 -4.99 118.68 117.13 1xlj s LEU 225 Ca 0.00 0.70 -0.22 0.00 -1.03 0.00 0.00 54.13 53.58 1xlj s LEU 225 Cb 0.00 -3.50 0.01 0.00 0.03 0.00 0.00 46.19 42.73 1xlj s LEU 225 CO 0.00 -1.14 0.72 0.21 0.23 0.00 0.00 176.35 176.37 1xlj s ASN 226 N -4.33 6.48 0.19 2.29 3.84 -1.26 -4.36 114.94 117.79 1xlj s ASN 226 Ca 0.55 0.21 -0.12 0.00 0.21 0.00 0.00 52.86 53.71 1xlj s ASN 226 Cb -0.11 -2.36 0.13 0.00 -0.55 0.00 0.00 41.25 38.36 1xlj s ASN 226 CO 0.45 -0.69 1.84 0.15 -2.79 0.00 0.00 177.10 176.06 1xlj h PHE 227 N 8.52 0.72 -0.41 0.43 3.57 -1.92 -1.55 116.94 126.31 1xlj h PHE 227 Ca -0.25 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.21 1xlj h PHE 227 Cb 1.10 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.58 1xlj h PHE 227 CO 0.77 0.43 0.02 1.15 -2.23 0.00 0.00 178.31 178.46 1xlj h THR 228 N 0.77 1.21 -0.35 4.41 2.02 -1.92 -1.70 112.91 117.36 1xlj h THR 228 Ca 0.24 -0.84 -0.02 0.00 0.77 0.00 0.00 66.41 66.56 1xlj h THR 228 Cb -0.02 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1xlj h THR 228 CO -0.08 0.29 0.13 0.45 0.37 0.00 0.00 175.52 176.68 1xlj h HIS 229 N 0.61 0.54 0.09 3.16 3.86 -1.82 0.24 115.15 121.83 1xlj h HIS 229 Ca 0.13 -0.05 -0.00 0.00 -1.16 0.00 0.00 60.37 59.29 1xlj h HIS 229 Cb 0.35 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 28.66 1xlj h HIS 229 CO 0.01 0.51 -0.04 0.78 0.86 0.00 0.00 177.93 180.05 1xlj h GLY 230 N 0.41 -0.13 1.29 2.45 0.00 -1.12 -2.18 103.07 103.80 1xlj h GLY 230 Ca 0.11 0.05 -0.07 0.00 0.00 0.00 0.00 47.33 47.42 1xlj h GLY 230 CO -0.01 -0.05 0.03 0.16 0.00 0.00 0.00 176.54 176.67 1xlj h ILE 231 N -0.24 1.25 -0.32 2.60 3.07 -1.33 -1.81 117.51 120.73 1xlj h ILE 231 Ca -0.01 -1.01 0.07 0.00 1.55 0.00 0.00 64.86 65.46 1xlj h ILE 231 Cb 0.20 0.82 -0.08 0.00 -0.27 0.00 0.00 36.82 37.49 1xlj h ILE 231 CO 0.02 0.36 -0.23 0.00 -1.05 0.00 0.00 178.15 177.26 1xlj h ALA 232 N 1.22 -0.03 -0.83 0.16 0.00 -0.88 0.50 119.26 119.40 1xlj h ALA 232 Ca 0.16 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1xlj h ALA 232 Cb 0.45 0.50 -0.04 0.00 0.00 0.00 0.00 17.79 18.70 1xlj h ALA 232 CO 0.02 -0.62 0.53 0.37 0.00 0.00 0.00 179.25 179.55 1xlj h GLN 233 N -0.19 1.11 0.12 0.00 4.15 -0.89 0.22 115.11 119.62 1xlj h GLN 233 Ca 0.16 -0.08 -0.01 0.00 0.77 0.00 0.00 58.65 59.50 1xlj h GLN 233 Cb 0.45 -0.24 0.00 0.00 0.21 0.00 0.00 27.48 27.89 1xlj h GLN 233 CO -0.44 0.75 -0.06 0.00 -1.93 0.00 0.00 178.83 177.16 1xlj h ALA 234 N 1.29 -0.16 -0.30 3.38 0.00 -0.59 -1.81 119.26 121.08 1xlj h ALA 234 Ca 0.30 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.17 1xlj h ALA 234 Cb -0.10 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1xlj h ALA 234 CO -0.06 -0.54 0.09 1.25 0.00 0.00 0.00 179.25 179.99 1xlj h LEU 235 N -0.26 0.08 -1.01 0.00 6.46 0.36 -0.76 115.31 120.17 1xlj h LEU 235 Ca -0.02 0.04 0.13 0.00 -0.12 0.00 0.00 57.88 57.91 1xlj h LEU 235 Cb 0.21 0.04 -0.09 0.00 -0.73 0.00 0.00 40.66 40.09 1xlj h LEU 235 CO 0.03 0.08 0.63 -0.25 -0.62 0.00 0.00 178.44 178.30 1xlj h TRP 236 N 0.21 1.13 0.00 1.25 7.01 -0.52 0.15 115.95 125.18 1xlj h TRP 236 Ca 0.14 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.17 1xlj h TRP 236 Cb 0.12 -0.36 0.00 0.00 -2.10 0.00 0.00 29.16 26.82 1xlj h TRP 236 CO -0.15 0.42 -0.13 0.00 -2.79 0.00 0.00 178.44 175.79 1xlj n ALA 237 N -2.35 2.61 -3.21 2.65 0.00 -0.69 -4.92 120.51 114.61 1xlj n ALA 237 Ca 0.20 -0.15 -0.14 0.00 0.00 0.00 0.00 53.44 53.34 1xlj n ALA 237 Cb 0.39 -1.38 0.08 0.00 0.00 0.00 0.00 19.45 18.53 1xlj n ALA 237 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1xlj n GLU 238 N -1.60 -5.50 0.00 0.00 1.02 0.51 -4.93 120.64 110.15 1xlj n GLU 238 Ca 0.06 0.73 0.00 0.00 -0.02 0.00 0.00 57.16 57.93 1xlj n GLU 238 Cb 0.35 -5.38 0.00 0.00 -0.02 0.00 0.00 31.44 26.39 1xlj n GLU 238 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1xlj n LYS 239 N -3.65 1.53 -2.75 3.49 4.76 -0.40 -4.92 118.16 116.23 1xlj n LYS 239 Ca -0.24 -1.11 -0.43 0.00 -2.87 0.00 0.00 58.31 53.66 1xlj n LYS 239 Cb 0.64 -0.97 -0.02 0.00 -1.84 0.00 0.00 35.03 32.84 1xlj n LYS 239 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1xlj s LEU 240 N -0.62 4.33 0.09 -0.35 2.96 -1.24 -0.61 118.68 123.24 1xlj s LEU 240 Ca 0.00 -2.02 0.16 0.00 -0.22 0.00 0.00 54.13 52.05 1xlj s LEU 240 Cb 0.00 -2.49 -0.11 0.00 0.50 0.00 0.00 46.19 44.09 1xlj s LEU 240 CO 0.00 -1.19 0.91 -0.26 -1.32 0.00 0.00 176.35 174.48 1xlj h PHE 241 N 8.78 0.00 -3.34 5.38 -1.00 -1.84 -3.48 116.94 121.44 1xlj h PHE 241 Ca 0.23 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.98 1xlj h PHE 241 Cb 0.98 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.48 1xlj h PHE 241 CO 1.23 0.59 0.08 -1.58 -1.61 0.00 0.00 178.31 177.02 1xlj s HIS 242 N -2.92 0.21 -0.04 -0.55 2.46 -1.08 -4.89 115.29 108.49 1xlj s HIS 242 Ca -0.02 -0.66 -0.14 0.00 0.47 0.00 0.00 55.06 54.71 1xlj s HIS 242 Cb 0.09 0.49 0.02 0.00 -0.13 0.00 0.00 32.58 33.05 1xlj s HIS 242 CO 0.80 -1.23 0.31 -1.50 -2.47 0.00 0.00 174.74 170.65 1xlj s ILE 243 N -3.45 0.05 -0.21 0.89 2.07 -1.26 -4.19 121.20 115.10 1xlj s ILE 243 Ca 0.18 -0.38 0.00 0.00 -1.41 0.00 0.00 60.65 59.04 1xlj s ILE 243 Cb -0.03 -0.58 0.02 0.00 0.13 0.00 0.00 42.46 42.00 1xlj s ILE 243 CO 0.10 -0.21 -0.15 -1.81 -1.91 0.00 0.00 174.94 170.96 1xlj s ASP 244 N -1.02 3.63 -0.11 4.50 1.01 -0.87 -3.47 116.67 120.34 1xlj s ASP 244 Ca -0.11 -0.78 -0.04 0.00 0.71 0.00 0.00 52.55 52.33 1xlj s ASP 244 Cb -0.05 -1.54 -0.03 0.00 1.01 0.00 0.00 42.92 42.31 1xlj s ASP 244 CO 0.03 -0.05 0.02 -0.76 0.21 0.00 0.00 175.17 174.63 1xlj s LEU 245 N 1.28 3.68 0.00 1.23 1.43 0.34 -2.54 118.68 124.11 1xlj s LEU 245 Ca 0.02 0.15 -0.01 0.00 -1.03 0.00 0.00 54.13 53.25 1xlj s LEU 245 Cb -0.15 -1.87 0.00 0.00 0.03 0.00 0.00 46.19 44.21 1xlj s LEU 245 CO -0.10 0.33 0.06 -0.46 0.23 0.00 0.00 176.35 176.41 1xlj n ASN 246 N 2.49 -0.08 -4.31 2.29 0.23 -1.26 -2.21 115.26 112.41 1xlj n ASN 246 Ca -0.18 -1.04 -0.23 0.00 -0.53 0.00 0.00 54.58 52.61 1xlj n ASN 246 Cb 0.53 0.13 -0.12 0.00 -2.08 0.00 0.00 39.78 38.24 1xlj n ASN 246 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1xlj s GLY 247 N -2.19 1.31 -0.13 4.83 0.00 -0.69 -4.42 107.32 106.03 1xlj s GLY 247 Ca 0.01 -1.37 -0.06 0.00 0.00 0.00 0.00 44.72 43.30 1xlj s GLY 247 CO 0.00 -1.40 0.30 1.62 0.00 0.00 0.00 173.10 173.62 1xlj s GLN 248 N -2.39 0.26 -1.05 2.90 2.00 -1.26 -2.01 119.66 118.11 1xlj s GLN 248 Ca 0.11 0.63 -0.06 0.00 -2.00 0.00 0.00 55.36 54.05 1xlj s GLN 248 Cb -0.08 -0.08 0.28 0.00 0.80 0.00 0.00 33.01 33.93 1xlj s GLN 248 CO 0.05 -0.17 1.15 0.54 -0.50 0.00 0.00 175.29 176.36 1xlj n ARG 249 N 4.33 3.61 0.00 1.67 1.74 -1.26 -3.59 116.66 123.17 1xlj n ARG 249 Ca -0.23 -4.50 0.00 0.00 -0.77 0.00 0.00 57.85 52.35 1xlj n ARG 249 Cb 0.53 -2.50 0.00 0.00 -1.02 0.00 0.00 32.46 29.47 1xlj n ARG 249 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xlj n GLY 250 N 2.15 0.23 3.56 -0.13 0.00 -1.26 -4.84 105.19 104.91 1xlj n GLY 250 Ca 0.24 -1.95 -0.42 0.00 0.00 0.00 0.00 46.02 43.89 1xlj n GLY 250 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xlj s ILE 251 N -1.36 3.98 0.00 -0.61 1.01 -1.26 -4.62 121.20 118.34 1xlj s ILE 251 Ca 0.00 0.68 0.00 0.00 0.00 0.00 0.00 60.65 61.33 1xlj s ILE 251 Cb 0.00 -4.76 0.00 0.00 0.01 0.00 0.00 42.46 37.71 1xlj s ILE 251 CO 0.00 -1.46 0.00 2.29 0.00 0.00 0.00 174.94 175.77 1xlj n LYS 252 N 8.58 0.00 -1.33 2.79 2.85 -1.26 -5.10 118.16 124.69 1xlj n LYS 252 Ca 0.06 0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 56.96 1xlj n LYS 252 Cb 0.49 0.00 0.09 0.00 -0.65 0.00 0.00 35.03 34.95 1xlj n LYS 252 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 177.40 179.83 1xlj n TYR 253 N 0.00 0.42 -2.08 5.58 4.11 -1.26 -4.87 117.16 119.07 1xlj n TYR 253 Ca 0.00 0.39 -0.43 0.00 -0.00 0.00 0.00 57.90 57.86 1xlj n TYR 253 Cb 0.00 -2.05 -0.03 0.00 -0.00 0.00 0.00 39.34 37.26 1xlj n TYR 253 CO 0.00 0.00 0.00 0.16 -0.00 0.00 0.00 176.86 177.02 1xlj s ASP 254 N -1.63 6.55 0.01 9.48 -4.77 -1.26 -4.88 116.67 120.18 1xlj s ASP 254 Ca 0.72 1.93 0.06 0.00 -3.30 0.00 0.00 52.55 51.95 1xlj s ASP 254 Cb -0.34 -2.53 -0.24 0.00 -1.09 0.00 0.00 42.92 38.71 1xlj s ASP 254 CO 0.52 -1.07 0.87 1.56 0.70 0.00 0.00 175.17 177.75 1xlj h GLN 255 N 10.03 0.08 -6.05 2.11 4.20 -1.89 -3.49 115.11 120.10 1xlj h GLN 255 Ca -0.36 -0.14 -0.41 0.00 0.06 0.00 0.00 58.65 57.80 1xlj h GLN 255 Cb 1.16 0.05 0.06 0.00 0.30 0.00 0.00 27.48 29.06 1xlj h GLN 255 CO 0.97 0.84 -0.82 -0.25 -0.67 0.00 0.00 178.83 178.91 1xlj n ASP 256 N -3.26 -1.52 -4.09 1.46 8.00 -1.22 -4.77 116.55 111.14 1xlj n ASP 256 Ca -0.13 -0.79 -0.30 0.00 0.71 0.00 0.00 54.79 54.28 1xlj n ASP 256 Cb 1.02 -4.18 0.19 0.00 -0.02 0.00 0.00 41.12 38.13 1xlj n ASP 256 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xlj s LEU 257 N -6.68 2.53 0.50 0.64 1.43 -0.85 -0.25 118.68 115.99 1xlj s LEU 257 Ca 0.05 0.30 -0.22 0.00 -1.03 0.00 0.00 54.13 53.23 1xlj s LEU 257 Cb -0.02 -2.30 -0.07 0.00 0.03 0.00 0.00 46.19 43.83 1xlj s LEU 257 CO 0.80 -2.87 1.18 -0.69 0.23 0.00 0.00 176.35 175.00 1xlj s VAL 258 N -3.81 2.99 0.13 -1.59 1.01 -1.26 -1.71 120.40 116.16 1xlj s VAL 258 Ca 0.74 0.71 -0.32 0.00 0.00 0.00 0.00 61.98 63.11 1xlj s VAL 258 Cb -0.04 -3.34 -0.11 0.00 0.00 0.00 0.00 36.38 32.89 1xlj s VAL 258 CO 0.53 -0.05 1.79 0.33 0.00 0.00 0.00 175.10 177.71 1xlj n PHE 259 N -0.79 2.61 0.00 5.22 7.35 -1.26 -1.13 117.46 129.45 1xlj n PHE 259 Ca 0.09 -0.06 0.00 0.00 -0.76 0.00 0.00 57.45 56.72 1xlj n PHE 259 Cb 0.48 -2.70 0.00 0.00 0.35 0.00 0.00 39.48 37.62 1xlj n PHE 259 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1xlj n GLY 260 N 4.11 2.33 0.83 7.13 0.00 -1.26 -4.77 105.19 113.55 1xlj n GLY 260 Ca 0.18 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.30 1xlj n GLY 260 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1xlj n HIS 261 N -1.67 0.44 0.00 1.61 8.25 -0.29 -4.52 115.22 119.04 1xlj n HIS 261 Ca 0.00 -0.22 0.00 0.00 -0.26 0.00 0.00 57.72 57.24 1xlj n HIS 261 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1xlj n HIS 261 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xlj n GLY 262 N 1.27 1.16 3.55 -1.41 0.00 -1.26 -4.77 105.19 103.74 1xlj n GLY 262 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1xlj n GLY 262 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xlj s ASP 263 N -0.10 5.68 0.12 1.61 -1.08 -1.24 -4.89 116.67 116.78 1xlj s ASP 263 Ca 0.00 -0.10 -0.16 0.00 -0.52 0.00 0.00 52.55 51.77 1xlj s ASP 263 Cb 0.00 -2.55 -0.02 0.00 -1.46 0.00 0.00 42.92 38.89 1xlj s ASP 263 CO 0.00 -2.14 1.62 0.25 0.52 0.00 0.00 175.17 175.43 1xlj h LEU 264 N 14.94 0.57 -0.76 -1.34 5.85 -1.94 -1.87 115.31 130.76 1xlj h LEU 264 Ca -0.24 -0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.24 1xlj h LEU 264 Cb 1.10 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.95 1xlj h LEU 264 CO 1.25 0.65 0.40 0.74 -0.34 0.00 0.00 178.44 181.14 1xlj h THR 265 N 0.46 1.23 -0.72 1.05 2.02 -1.95 -1.98 112.91 113.03 1xlj h THR 265 Ca 0.12 -0.61 -0.07 0.00 0.77 0.00 0.00 66.41 66.62 1xlj h THR 265 Cb 0.30 0.25 -0.03 0.00 -1.74 0.00 0.00 68.15 66.93 1xlj h THR 265 CO 0.00 0.27 0.18 -1.28 0.37 0.00 0.00 175.52 175.06 1xlj h SER 266 N 1.05 1.08 -0.78 4.18 0.87 -1.95 -2.65 113.55 115.35 1xlj h SER 266 Ca 0.26 -0.23 -0.04 0.00 -1.23 0.00 0.00 61.79 60.56 1xlj h SER 266 Cb 0.06 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.71 1xlj h SER 266 CO -0.04 1.03 0.32 0.00 -0.53 0.00 0.00 176.83 177.61 1xlj h ALA 267 N 1.11 1.02 0.06 6.23 0.00 -0.96 0.07 119.26 126.79 1xlj h ALA 267 Ca 0.23 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1xlj h ALA 267 Cb 0.36 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 1xlj h ALA 267 CO 0.00 0.64 -0.51 0.35 0.00 0.00 0.00 179.25 179.73 1xlj h PHE 268 N 1.14 -1.48 -0.03 0.00 3.57 -1.10 0.17 116.94 119.21 1xlj h PHE 268 Ca 0.26 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.76 1xlj h PHE 268 Cb 0.21 0.64 -0.01 0.00 2.79 0.00 0.00 35.95 39.58 1xlj h PHE 268 CO 0.02 -0.57 -0.20 0.74 -2.23 0.00 0.00 178.31 176.07 1xlj h PHE 269 N -0.69 0.04 -0.01 0.41 0.04 -1.32 -0.25 116.94 115.16 1xlj h PHE 269 Ca 0.01 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.78 1xlj h PHE 269 Cb 0.73 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.87 1xlj h PHE 269 CO -0.47 0.24 -0.00 1.15 -0.60 0.00 0.00 178.31 178.63 1xlj h THR 270 N 0.04 1.25 -0.43 -1.55 2.02 -0.57 -1.19 112.91 112.49 1xlj h THR 270 Ca 0.01 -0.75 0.03 0.00 0.77 0.00 0.00 66.41 66.47 1xlj h THR 270 Cb 0.38 1.75 -0.04 0.00 -1.74 0.00 0.00 68.15 68.50 1xlj h THR 270 CO 0.03 0.20 0.21 0.58 0.37 0.00 0.00 175.52 176.90 1xlj h VAL 271 N -0.30 0.97 -0.25 3.16 2.07 0.08 -0.39 116.25 121.58 1xlj h VAL 271 Ca 0.00 -0.15 0.05 0.00 0.82 0.00 0.00 66.70 67.43 1xlj h VAL 271 Cb 0.32 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 30.54 1xlj h VAL 271 CO 0.00 0.08 -0.10 -0.78 0.02 0.00 0.00 177.57 176.79 1xlj h ASP 272 N 0.43 -0.34 -0.44 0.57 3.58 -1.03 0.51 116.42 119.70 1xlj h ASP 272 Ca 0.18 0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.72 1xlj h ASP 272 Cb 0.09 0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.32 1xlj h ASP 272 CO -0.13 -0.13 0.28 0.25 -2.88 0.00 0.00 179.24 176.63 1xlj h LEU 273 N -0.05 0.52 -0.41 2.28 5.85 -0.71 -0.11 115.31 122.68 1xlj h LEU 273 Ca 0.13 -0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.70 1xlj h LEU 273 Cb 0.25 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1xlj h LEU 273 CO -0.29 0.41 -0.17 -0.07 -0.34 0.00 0.00 178.44 177.98 1xlj h LEU 274 N 0.59 0.87 0.04 2.25 3.38 -0.48 -0.91 115.31 121.04 1xlj h LEU 274 Ca 0.16 -0.39 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 1xlj h LEU 274 Cb -0.03 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.48 1xlj h LEU 274 CO -0.03 1.06 -0.02 -0.33 0.09 0.00 0.00 178.44 179.21 1xlj h GLU 275 N 0.66 -0.05 0.00 1.13 4.39 -0.89 -3.41 114.58 116.42 1xlj h GLU 275 Ca 0.10 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.57 1xlj h GLU 275 Cb 0.72 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.35 1xlj h GLU 275 CO 0.05 0.46 -1.52 -0.91 -1.16 0.00 0.00 179.01 175.94 1xlj h ASN 276 N -0.97 0.00 0.00 1.42 2.35 -1.19 -3.51 115.58 113.69 1xlj h ASN 276 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1xlj h ASN 276 Cb 0.54 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.91 1xlj h ASN 276 CO 0.01 0.81 0.00 0.61 -1.65 0.00 0.00 177.43 177.21 1xlj n GLY 277 N 1.47 -0.26 3.86 2.83 0.00 -0.35 -4.82 105.19 107.93 1xlj n GLY 277 Ca -0.12 -1.07 -0.37 0.00 0.00 0.00 0.00 46.02 44.46 1xlj n GLY 277 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xlj s PHE 278 N 0.00 3.58 0.40 1.61 0.08 -1.26 -4.55 117.98 117.84 1xlj s PHE 278 Ca 0.00 0.52 0.21 0.00 0.12 0.00 0.00 56.93 57.78 1xlj s PHE 278 Cb 0.00 -1.98 1.18 0.00 -0.57 0.00 0.00 43.02 41.65 1xlj s PHE 278 CO 0.00 0.69 1.72 -1.35 -0.10 0.00 0.00 175.22 176.17 1xlj h PRO 279 N 5.16 0.30 -0.33 0.24 0.11 -1.97 0.42 132.00 135.94 1xlj h PRO 279 Ca -0.53 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.56 1xlj h PRO 279 Cb 1.22 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1xlj h PRO 279 CO 0.60 0.20 0.00 0.09 -0.21 0.00 0.00 178.00 178.68 1xlj n ASN 280 N -4.70 3.37 0.00 -2.05 3.02 -1.26 -5.02 115.26 108.62 1xlj n ASN 280 Ca 0.29 -1.98 0.00 0.00 -0.03 0.00 0.00 54.58 52.86 1xlj n ASN 280 Cb 1.03 -0.21 0.00 0.00 -0.61 0.00 0.00 39.78 40.00 1xlj n ASN 280 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xlj n GLY 281 N 1.45 0.10 0.00 7.41 0.00 0.15 -5.11 105.19 109.19 1xlj n GLY 281 Ca 0.18 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1xlj n GLY 281 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xlj n GLY 282 N 0.44 0.09 3.76 -0.02 0.00 -1.26 -4.79 105.19 103.41 1xlj n GLY 282 Ca 0.00 -1.12 -0.33 0.00 0.00 0.00 0.00 46.02 44.57 1xlj n GLY 282 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xlj s PRO 283 N -2.00 2.61 0.03 1.61 0.05 -1.26 -4.89 135.00 131.14 1xlj s PRO 283 Ca 0.00 1.47 0.02 0.00 0.05 0.00 0.00 61.00 62.53 1xlj s PRO 283 Cb 0.00 -1.92 -0.02 0.00 0.05 0.00 0.00 34.50 32.61 1xlj s PRO 283 CO 0.00 -1.41 -0.06 0.15 0.05 0.00 0.00 177.00 175.72 1xlj s LYS 284 N -4.08 0.45 -0.30 4.56 -0.14 -1.26 -4.37 119.74 114.60 1xlj s LYS 284 Ca 0.68 -0.58 -0.10 0.00 -1.36 0.00 0.00 55.97 54.61 1xlj s LYS 284 Cb -0.22 -0.25 -0.02 0.00 -1.68 0.00 0.00 37.83 35.65 1xlj s LYS 284 CO 0.43 0.05 0.15 -0.47 -0.76 0.00 0.00 175.35 174.75 1xlj s TYR 285 N -1.06 3.17 -0.22 3.18 5.04 -1.26 -4.97 117.35 121.22 1xlj s TYR 285 Ca -0.08 -0.39 0.16 0.00 -2.44 0.00 0.00 57.07 54.32 1xlj s TYR 285 Cb -0.08 -2.35 0.46 0.00 0.35 0.00 0.00 41.96 40.34 1xlj s TYR 285 CO 0.00 -0.38 1.35 -2.37 -1.34 0.00 0.00 175.55 172.82 1xlj n THR 286 N 5.00 2.10 -1.23 4.34 5.66 -1.26 -4.90 114.28 123.99 1xlj n THR 286 Ca -0.14 -1.87 0.00 0.00 -3.05 0.00 0.00 64.05 58.99 1xlj n THR 286 Cb 0.50 -0.18 0.00 0.00 -1.55 0.00 0.00 70.33 69.10 1xlj n THR 286 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1xlj n GLY 287 N -0.59 0.37 3.84 1.09 0.00 -1.26 -5.07 105.19 103.56 1xlj n GLY 287 Ca 0.19 -1.83 -0.32 0.00 0.00 0.00 0.00 46.02 44.06 1xlj n GLY 287 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xlj s PRO 288 N 0.03 3.89 -0.65 1.61 0.04 -1.26 -5.00 135.00 133.66 1xlj s PRO 288 Ca 0.00 0.99 -0.12 0.00 0.04 0.00 0.00 61.00 61.91 1xlj s PRO 288 Cb 0.00 -2.13 0.17 0.00 0.04 0.00 0.00 34.50 32.58 1xlj s PRO 288 CO 0.00 -0.32 0.57 1.03 0.04 0.00 0.00 177.00 178.32 1xlj s ARG 289 N -4.02 3.08 -0.15 4.56 3.00 -0.05 -4.33 118.95 121.03 1xlj s ARG 289 Ca 0.60 -2.13 -0.13 0.00 0.00 0.00 0.00 55.73 54.07 1xlj s ARG 289 Cb -0.11 -4.20 -0.05 0.00 0.00 0.00 0.00 34.95 30.59 1xlj s ARG 289 CO 0.31 -1.27 0.27 -1.58 0.00 0.00 0.00 175.30 173.03 1xlj s HIS 290 N 0.77 3.48 -0.37 -0.53 2.46 -1.23 -1.27 115.29 118.61 1xlj s HIS 290 Ca 0.11 0.58 -0.12 0.00 0.47 0.00 0.00 55.06 56.11 1xlj s HIS 290 Cb -0.20 -2.29 0.01 0.00 -0.13 0.00 0.00 32.58 29.97 1xlj s HIS 290 CO -0.03 0.30 0.23 -0.06 -2.47 0.00 0.00 174.74 172.70 1xlj s PHE 291 N 0.27 3.23 -0.66 3.88 0.08 -0.67 -0.50 117.98 123.61 1xlj s PHE 291 Ca 0.16 -0.70 -0.04 0.00 0.12 0.00 0.00 56.93 56.48 1xlj s PHE 291 Cb -0.13 -2.47 0.17 0.00 -0.57 0.00 0.00 43.02 40.02 1xlj s PHE 291 CO 0.04 -0.56 0.48 0.34 -0.10 0.00 0.00 175.22 175.42 1xlj s ASP 292 N 1.62 5.38 0.32 1.36 -1.08 -0.94 -3.94 116.67 119.39 1xlj s ASP 292 Ca 0.04 -2.90 0.06 0.00 -0.52 0.00 0.00 52.55 49.24 1xlj s ASP 292 Cb -0.19 -1.89 -0.02 0.00 -1.46 0.00 0.00 42.92 39.36 1xlj s ASP 292 CO 0.08 -0.37 0.23 0.00 0.52 0.00 0.00 175.17 175.63 1xlj n TYR 293 N 3.45 -0.56 -3.71 -5.34 4.11 -1.26 -4.60 117.16 109.25 1xlj n TYR 293 Ca 0.09 -2.53 -0.16 0.00 -0.00 0.00 0.00 57.90 55.30 1xlj n TYR 293 Cb 0.38 0.21 -0.16 0.00 -0.00 0.00 0.00 39.34 39.78 1xlj n TYR 293 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.86 177.01 1xlj s LYS 294 N -3.27 0.02 0.12 -3.48 1.02 0.65 -4.31 119.74 110.49 1xlj s LYS 294 Ca 0.33 0.40 -0.31 0.00 0.02 0.00 0.00 55.97 56.40 1xlj s LYS 294 Cb 0.02 -0.28 -0.08 0.00 -0.52 0.00 0.00 37.83 36.96 1xlj s LYS 294 CO 0.23 -0.24 1.49 -2.14 -0.92 0.00 0.00 175.35 173.77 1xlj s PRO 295 N 1.67 4.27 0.21 -1.68 0.02 -1.26 -4.61 135.00 133.63 1xlj s PRO 295 Ca -0.03 2.20 -0.31 0.00 0.02 0.00 0.00 61.00 62.87 1xlj s PRO 295 Cb -0.12 -3.29 -0.15 0.00 0.02 0.00 0.00 34.50 30.96 1xlj s PRO 295 CO -0.05 -0.55 1.22 0.43 -0.33 0.00 0.00 177.00 177.72 1xlj n SER 296 N 4.30 1.79 0.30 2.53 7.64 -1.26 -4.87 113.62 124.04 1xlj n SER 296 Ca 0.13 1.15 0.17 0.00 1.01 0.00 0.00 58.87 61.33 1xlj n SER 296 Cb 0.41 -1.30 0.94 0.00 -1.01 0.00 0.00 64.21 63.26 1xlj n SER 296 CO 0.00 0.00 0.00 0.08 -3.01 0.00 0.00 175.04 172.11 1xlj h ARG 297 N 3.40 0.00 0.00 1.43 0.11 -1.92 -2.79 114.38 114.61 1xlj h ARG 297 Ca -0.43 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.65 1xlj h ARG 297 Cb 1.32 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.40 1xlj h ARG 297 CO 0.70 0.03 0.00 1.79 0.10 0.00 0.00 179.97 182.59 1xlj h THR 298 N 0.00 0.00 -2.98 0.08 1.35 -1.99 -3.46 112.91 105.92 1xlj h THR 298 Ca -0.00 -0.50 -0.66 0.00 -0.55 0.00 0.00 66.41 64.70 1xlj h THR 298 Cb 0.13 1.46 -0.09 0.00 -1.73 0.00 0.00 68.15 67.92 1xlj h THR 298 CO 0.00 0.00 -0.55 -1.81 -0.25 0.00 0.00 175.52 172.92 1xlj s ASP 299 N -5.46 5.91 0.95 5.36 1.11 -1.05 -5.14 116.67 118.34 1xlj s ASP 299 Ca 0.02 0.24 0.00 0.00 0.18 0.00 0.00 52.55 53.00 1xlj s ASP 299 Cb 0.09 -1.77 0.00 0.00 1.07 0.00 0.00 42.92 42.31 1xlj s ASP 299 CO 0.53 0.30 0.00 0.61 1.18 0.00 0.00 175.17 177.79 1xlj n GLY 300 N 1.35 -1.11 0.27 0.21 0.00 -1.26 -4.81 105.19 99.85 1xlj n GLY 300 Ca -0.14 -1.67 0.15 0.00 0.00 0.00 0.00 46.02 44.36 1xlj n GLY 300 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1xlj h TYR 301 N -0.95 0.00 -0.59 1.61 0.05 -1.99 -1.47 116.97 113.64 1xlj h TYR 301 Ca 0.00 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.70 1xlj h TYR 301 Cb 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.72 1xlj h TYR 301 CO 0.00 0.08 0.05 -0.44 -1.05 0.00 0.00 178.16 176.80 1xlj h ASP 302 N 0.00 0.95 -0.59 3.88 3.32 -1.99 -1.88 116.42 120.11 1xlj h ASP 302 Ca -0.00 -0.24 -0.08 0.00 0.02 0.00 0.00 57.03 56.73 1xlj h ASP 302 Cb 0.36 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 1xlj h ASP 302 CO 0.01 0.98 0.06 1.23 -1.72 0.00 0.00 179.24 179.81 1xlj h GLY 303 N 1.01 1.08 0.68 2.75 0.00 -1.63 -0.41 103.07 106.55 1xlj h GLY 303 Ca 0.18 -0.74 -0.00 0.00 0.00 0.00 0.00 47.33 46.76 1xlj h GLY 303 CO 0.02 0.69 -0.33 -2.08 0.00 0.00 0.00 176.54 174.83 1xlj h VAL 304 N 0.90 0.31 0.00 4.60 2.07 -0.73 0.31 116.25 123.71 1xlj h VAL 304 Ca 0.18 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.60 1xlj h VAL 304 Cb 0.47 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1xlj h VAL 304 CO 0.02 0.00 -0.45 -0.50 0.02 0.00 0.00 177.57 176.66 1xlj h TRP 305 N -0.72 0.00 -0.49 1.57 4.06 -1.36 -1.86 115.95 117.15 1xlj h TRP 305 Ca -0.03 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 60.88 1xlj h TRP 305 Cb 0.64 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.78 1xlj h TRP 305 CO -0.18 0.45 0.13 -0.44 -3.56 0.00 0.00 178.44 174.83 1xlj h ASP 306 N 0.00 0.74 -0.41 -3.49 3.32 -0.63 -2.36 116.42 113.59 1xlj h ASP 306 Ca -0.00 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 56.81 1xlj h ASP 306 Cb 0.82 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 1xlj h ASP 306 CO 0.06 0.77 0.22 0.77 -1.72 0.00 0.00 179.24 179.34 1xlj h SER 307 N 0.67 0.52 -0.70 6.45 4.64 -0.00 0.19 113.55 125.31 1xlj h SER 307 Ca 0.16 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1xlj h SER 307 Cb 0.32 -0.13 -0.03 0.00 -0.31 0.00 0.00 62.40 62.24 1xlj h SER 307 CO 0.00 0.47 0.46 0.00 -0.87 0.00 0.00 176.83 176.88 1xlj h ALA 308 N 1.07 0.89 0.11 5.18 0.00 -1.21 -2.66 119.26 122.64 1xlj h ALA 308 Ca 0.14 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1xlj h ALA 308 Cb 0.07 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1xlj h ALA 308 CO -0.02 0.32 -0.08 0.87 0.00 0.00 0.00 179.25 180.33 1xlj h LYS 309 N 0.95 -0.20 -0.35 0.00 1.57 -1.26 -3.12 116.57 114.17 1xlj h LYS 309 Ca 0.26 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.06 1xlj h LYS 309 Cb -0.10 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 1xlj h LYS 309 CO -0.05 -0.13 0.23 0.00 -0.57 0.00 0.00 179.45 178.93 1xlj h ALA 310 N 0.68 1.82 -0.19 3.86 0.00 -0.70 -0.54 119.26 124.18 1xlj h ALA 310 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xlj h ALA 310 Cb 0.18 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1xlj h ALA 310 CO -0.01 0.15 0.12 -0.91 0.00 0.00 0.00 179.25 178.61 1xlj h ASN 311 N 0.41 0.23 -0.26 0.00 2.35 -1.41 -1.34 115.58 115.56 1xlj h ASN 311 Ca 0.13 -0.03 -0.05 0.00 -0.55 0.00 0.00 56.30 55.81 1xlj h ASN 311 Cb 0.04 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 1xlj h ASN 311 CO -0.03 0.18 -0.05 0.24 -1.65 0.00 0.00 177.43 176.13 1xlj h MET 312 N 0.25 0.48 0.24 0.81 2.86 -1.53 -2.24 114.93 115.80 1xlj h MET 312 Ca 0.07 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 1xlj h MET 312 Cb -0.01 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 1xlj h MET 312 CO -0.01 0.69 -0.16 0.77 1.06 0.00 0.00 176.91 179.26 1xlj h SER 313 N 0.24 -0.41 -0.14 1.22 0.02 -0.92 -1.16 113.55 112.40 1xlj h SER 313 Ca 0.07 0.03 0.04 0.00 -0.84 0.00 0.00 61.79 61.09 1xlj h SER 313 Cb 0.50 0.13 -0.05 0.00 0.14 0.00 0.00 62.40 63.12 1xlj h SER 313 CO 0.02 -0.26 -0.17 0.24 -1.14 0.00 0.00 176.83 175.53 1xlj h MET 314 N -0.40 -0.20 -0.63 3.45 2.07 -1.30 0.23 114.93 118.15 1xlj h MET 314 Ca -0.02 0.01 0.02 0.00 -2.07 0.00 0.00 59.70 57.64 1xlj h MET 314 Cb 0.34 0.05 -0.04 0.00 -1.87 0.00 0.00 31.60 30.08 1xlj h MET 314 CO 0.01 -0.13 0.40 -0.92 1.07 0.00 0.00 176.91 177.34 1xlj h TYR 315 N -0.21 0.75 -0.46 -0.22 5.03 -1.26 -0.60 116.97 120.00 1xlj h TYR 315 Ca 0.10 0.02 -0.13 0.00 2.58 0.00 0.00 58.73 61.30 1xlj h TYR 315 Cb 0.35 -0.25 -0.01 0.00 1.55 0.00 0.00 36.73 38.37 1xlj h TYR 315 CO -0.29 0.44 -0.24 -0.07 -1.32 0.00 0.00 178.16 176.69 1xlj h LEU 316 N 0.79 0.99 0.08 2.82 3.38 -0.59 -0.41 115.31 122.37 1xlj h LEU 316 Ca 0.25 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1xlj h LEU 316 Cb -0.02 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 1xlj h LEU 316 CO -0.09 1.17 -0.07 -0.07 0.09 0.00 0.00 178.44 179.48 1xlj h LEU 317 N 0.82 -0.17 -0.59 1.67 3.38 -0.35 -2.35 115.31 117.73 1xlj h LEU 317 Ca 0.10 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1xlj h LEU 317 Cb 0.81 0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.59 1xlj h LEU 317 CO 0.07 -0.10 0.33 -0.07 0.09 0.00 0.00 178.44 178.75 1xlj h LEU 318 N -0.15 0.74 -0.68 1.67 3.38 -1.04 -2.61 115.31 116.61 1xlj h LEU 318 Ca 0.00 -0.09 0.09 0.00 0.09 0.00 0.00 57.88 57.97 1xlj h LEU 318 Cb 0.14 -0.19 -0.07 0.00 0.09 0.00 0.00 40.66 40.64 1xlj h LEU 318 CO -0.01 0.62 0.33 0.50 0.09 0.00 0.00 178.44 179.96 1xlj h LYS 319 N 0.80 0.55 0.18 1.13 3.64 -0.85 -0.66 116.57 121.36 1xlj h LYS 319 Ca 0.21 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.55 1xlj h LYS 319 Cb 0.04 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 1xlj h LYS 319 CO -0.03 0.37 -0.09 1.49 -2.27 0.00 0.00 179.45 178.92 1xlj h GLU 320 N 0.57 -0.23 -0.16 1.90 4.81 -1.33 -1.02 114.58 119.12 1xlj h GLU 320 Ca 0.33 0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.50 1xlj h GLU 320 Cb 0.35 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 1xlj h GLU 320 CO -0.26 -0.10 -0.27 0.00 -0.73 0.00 0.00 179.01 177.65 1xlj h ARG 321 N -0.31 0.30 0.00 1.92 3.08 -1.17 -2.21 114.38 115.99 1xlj h ARG 321 Ca -0.02 -0.11 -0.13 0.00 0.07 0.00 0.00 59.98 59.79 1xlj h ARG 321 Cb 0.24 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 1xlj h ARG 321 CO 0.04 0.55 -0.60 0.00 -1.07 0.00 0.00 179.97 178.89 1xlj h ALA 322 N 1.45 0.75 0.00 0.04 0.00 -1.01 -1.92 119.26 118.59 1xlj h ALA 322 Ca 0.04 -0.55 -0.19 0.00 0.00 0.00 0.00 54.91 54.21 1xlj h ALA 322 Cb 0.62 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 18.33 1xlj h ALA 322 CO 0.04 0.75 -0.75 -0.07 0.00 0.00 0.00 179.25 179.23 1xlj h LEU 323 N 0.00 0.66 -0.63 0.00 3.38 -1.00 -2.99 115.31 114.73 1xlj h LEU 323 Ca -0.01 -0.76 -0.03 0.00 0.09 0.00 0.00 57.88 57.18 1xlj h LEU 323 Cb 1.27 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.79 1xlj h LEU 323 CO 0.08 1.33 0.28 0.00 0.09 0.00 0.00 178.44 180.21 1xlj h ALA 324 N 0.34 0.81 0.34 1.53 0.00 -1.38 -2.20 119.26 118.70 1xlj h ALA 324 Ca -0.09 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1xlj h ALA 324 Cb 1.44 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 1xlj h ALA 324 CO 0.15 0.40 -0.39 0.35 0.00 0.00 0.00 179.25 179.76 1xlj h PHE 325 N 0.87 -1.08 -0.00 0.00 3.57 -1.42 -2.22 116.94 116.65 1xlj h PHE 325 Ca 0.21 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.60 1xlj h PHE 325 Cb 0.16 0.43 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 1xlj h PHE 325 CO 0.01 -0.54 -0.58 0.00 -2.23 0.00 0.00 178.31 174.97 1xlj h ARG 326 N -0.77 0.01 0.00 1.11 2.47 -1.50 -3.14 114.38 112.56 1xlj h ARG 326 Ca -0.02 -0.01 -0.05 0.00 -1.26 0.00 0.00 59.98 58.65 1xlj h ARG 326 Cb 0.71 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.02 1xlj h ARG 326 CO -0.10 0.59 -0.22 0.00 0.56 0.00 0.00 179.97 180.80 1xlj h ALA 327 N 1.41 1.01 -2.25 0.04 0.00 -1.31 -3.43 119.26 114.72 1xlj h ALA 327 Ca -0.01 -0.20 -0.55 0.00 0.00 0.00 0.00 54.91 54.16 1xlj h ALA 327 Cb 1.03 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1xlj h ALA 327 CO 0.08 0.27 1.06 0.34 0.00 0.00 0.00 179.25 181.00 1xlj s ASP 328 N -6.17 6.70 0.29 0.00 -1.08 -0.84 -4.93 116.67 110.63 1xlj s ASP 328 Ca 0.01 2.17 0.03 0.00 -0.52 0.00 0.00 52.55 54.24 1xlj s ASP 328 Cb 0.10 -2.53 0.65 0.00 -1.46 0.00 0.00 42.92 39.68 1xlj s ASP 328 CO 0.64 -0.90 1.78 -0.65 0.52 0.00 0.00 175.17 176.55 1xlj h PRO 329 N 9.35 0.72 -0.16 4.34 0.11 -1.89 0.16 132.00 144.62 1xlj h PRO 329 Ca -0.38 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.59 1xlj h PRO 329 Cb 1.17 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 1xlj h PRO 329 CO 0.96 0.47 -0.33 0.93 -0.21 0.00 0.00 178.00 179.82 1xlj h GLU 330 N 0.74 0.33 -0.14 1.05 5.08 -1.95 -2.36 114.58 117.32 1xlj h GLU 330 Ca 0.53 -0.14 -0.07 0.00 -1.00 0.00 0.00 59.36 58.68 1xlj h GLU 330 Cb 0.78 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.02 1xlj h GLU 330 CO -0.37 0.62 -0.21 0.28 -1.00 0.00 0.00 179.01 178.34 1xlj h VAL 331 N 0.29 1.36 -0.37 3.13 2.07 -1.01 -2.28 116.25 119.44 1xlj h VAL 331 Ca 0.04 -1.44 0.05 0.00 0.82 0.00 0.00 66.70 66.17 1xlj h VAL 331 Cb 0.72 1.98 -0.05 0.00 -1.52 0.00 0.00 31.29 32.42 1xlj h VAL 331 CO 0.05 0.42 0.09 1.56 0.02 0.00 0.00 177.57 179.72 1xlj h GLN 332 N -0.02 0.21 -0.06 1.57 4.20 -1.16 0.66 115.11 120.51 1xlj h GLN 332 Ca 0.01 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.72 1xlj h GLN 332 Cb 0.77 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.49 1xlj h GLN 332 CO 0.05 0.14 -0.02 1.49 -0.67 0.00 0.00 178.83 179.82 1xlj h GLU 333 N 0.22 0.00 -0.60 1.46 4.57 -1.47 -1.72 114.58 117.04 1xlj h GLU 333 Ca 0.18 -0.00 0.04 0.00 -1.18 0.00 0.00 59.36 58.40 1xlj h GLU 333 Cb 0.19 -0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.74 1xlj h GLU 333 CO -0.22 0.00 0.34 0.00 -1.18 0.00 0.00 179.01 177.95 1xlj h ALA 334 N 1.06 0.79 -0.54 2.92 0.00 -1.05 -1.15 119.26 121.28 1xlj h ALA 334 Ca 0.03 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.98 1xlj h ALA 334 Cb 0.05 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1xlj h ALA 334 CO -0.07 0.03 0.31 0.52 0.00 0.00 0.00 179.25 180.05 1xlj h MET 335 N 0.65 0.59 -0.05 0.00 2.86 -0.74 -1.52 114.93 116.73 1xlj h MET 335 Ca 0.26 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.86 1xlj h MET 335 Cb 0.11 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 31.64 1xlj h MET 335 CO -0.15 0.39 0.02 -0.22 1.06 0.00 0.00 176.91 178.01 1xlj h LYS 336 N 0.61 0.08 -0.69 1.72 3.64 -0.88 -1.35 116.57 119.70 1xlj h LYS 336 Ca 0.22 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.64 1xlj h LYS 336 Cb 0.06 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.81 1xlj h LYS 336 CO -0.12 0.26 0.40 1.15 -2.27 0.00 0.00 179.45 178.87 1xlj h THR 337 N -0.11 1.00 0.00 1.00 2.02 -0.94 -2.16 112.91 113.72 1xlj h THR 337 Ca 0.02 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.94 1xlj h THR 337 Cb 0.21 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 66.81 1xlj h THR 337 CO -0.00 0.14 0.00 -1.20 0.37 0.00 0.00 175.52 174.83 1xlj n SER 338 N -4.75 0.00 0.00 4.18 7.64 -0.60 -4.86 113.62 115.23 1xlj n SER 338 Ca 0.09 0.32 0.00 0.00 1.01 0.00 0.00 58.87 60.28 1xlj n SER 338 Cb 0.16 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.93 1xlj n SER 338 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xlj n GLY 339 N 0.86 0.56 0.26 0.23 0.00 -0.81 -4.97 105.19 101.32 1xlj n GLY 339 Ca 0.08 -0.74 -0.07 0.00 0.00 0.00 0.00 46.02 45.29 1xlj n GLY 339 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1xlj h VAL 340 N 0.00 1.21 -0.01 1.61 2.07 -1.49 -2.21 116.25 117.44 1xlj h VAL 340 Ca 0.00 -0.61 -0.25 0.00 0.82 0.00 0.00 66.70 66.66 1xlj h VAL 340 Cb 0.00 0.52 0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1xlj h VAL 340 CO 0.00 0.25 -0.99 -0.26 0.02 0.00 0.00 177.57 176.59 1xlj h PHE 341 N 0.81 0.86 -0.71 1.57 0.04 -1.88 -3.21 116.94 114.42 1xlj h PHE 341 Ca 0.20 -0.47 0.17 0.00 2.80 0.00 0.00 57.97 60.68 1xlj h PHE 341 Cb 0.13 -0.10 -0.04 0.00 2.20 0.00 0.00 35.95 38.14 1xlj h PHE 341 CO 0.00 1.29 0.49 1.49 -0.60 0.00 0.00 178.31 180.99 1xlj h GLU 342 N 0.33 0.18 0.00 1.51 4.81 -1.76 -1.59 114.58 118.06 1xlj h GLU 342 Ca -0.11 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.09 1xlj h GLU 342 Cb 1.64 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.97 1xlj h GLU 342 CO 0.19 0.12 -0.11 1.25 -0.73 0.00 0.00 179.01 179.73 1xlj h LEU 343 N 0.19 0.00 -0.96 1.64 5.85 -1.42 -2.82 115.31 117.79 1xlj h LEU 343 Ca 0.34 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.99 1xlj h LEU 343 Cb 1.09 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.11 1xlj h LEU 343 CO -0.06 0.11 -0.35 1.23 -0.34 0.00 0.00 178.44 179.02 1xlj h GLY 344 N 0.97 0.00 -3.76 3.75 0.00 -1.44 -3.44 103.07 99.15 1xlj h GLY 344 Ca -0.00 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.84 1xlj h GLY 344 CO 0.01 0.00 0.36 -0.54 0.00 0.00 0.00 176.54 176.38 1xlj s GLU 345 N -3.62 4.84 0.78 4.80 2.02 -1.07 -5.03 118.70 121.42 1xlj s GLU 345 Ca 0.00 1.52 -0.13 0.00 0.02 0.00 0.00 54.97 56.38 1xlj s GLU 345 Cb 0.11 -3.27 0.07 0.00 0.10 0.00 0.00 34.13 31.13 1xlj s GLU 345 CO 0.68 0.49 1.17 0.95 0.02 0.00 0.00 175.26 178.56 1xlj s THR 346 N -1.16 2.46 0.07 3.63 -4.23 -1.26 -4.94 115.64 110.21 1xlj s THR 346 Ca 0.41 0.19 -0.15 0.00 -1.18 0.00 0.00 61.69 60.96 1xlj s THR 346 Cb -0.27 -2.60 -0.18 0.00 1.34 0.00 0.00 72.50 70.80 1xlj s THR 346 CO 0.33 -0.15 1.25 0.74 -0.54 0.00 0.00 174.62 176.25 1xlj h THR 347 N -0.79 1.32 -3.24 3.99 2.02 -1.96 -3.44 112.91 110.81 1xlj h THR 347 Ca -0.46 -1.94 -0.57 0.00 0.77 0.00 0.00 66.41 64.21 1xlj h THR 347 Cb 1.28 2.14 -0.04 0.00 -1.74 0.00 0.00 68.15 69.79 1xlj h THR 347 CO 0.48 0.60 -0.20 -0.76 0.37 0.00 0.00 175.52 176.01 1xlj s LEU 348 N -8.46 4.28 0.54 2.58 1.43 -1.26 -5.09 118.68 112.70 1xlj s LEU 348 Ca -0.11 0.82 -0.16 0.00 -1.03 0.00 0.00 54.13 53.65 1xlj s LEU 348 Cb 0.07 -3.28 -0.07 0.00 0.03 0.00 0.00 46.19 42.94 1xlj s LEU 348 CO 0.87 0.07 1.00 0.20 0.23 0.00 0.00 176.35 178.72 1xlj s ASN 349 N -2.06 6.43 0.15 2.29 0.01 -1.26 -4.93 114.94 115.58 1xlj s ASN 349 Ca 0.39 1.59 -0.34 0.00 -0.71 0.00 0.00 52.86 53.79 1xlj s ASN 349 Cb -0.13 -2.51 -0.14 0.00 0.41 0.00 0.00 41.25 38.88 1xlj s ASN 349 CO 0.20 -0.72 1.57 0.00 -1.51 0.00 0.00 177.10 176.65 1xlj n ALA 350 N -1.82 1.23 0.00 0.60 0.00 -1.26 -0.43 120.51 118.83 1xlj n ALA 350 Ca 0.07 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.95 1xlj n ALA 350 Cb 0.54 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 17.65 1xlj n ALA 350 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xlj n GLY 351 N 3.38 2.96 3.74 0.00 0.00 -1.26 -5.01 105.19 108.99 1xlj n GLY 351 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1xlj n GLY 351 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xlj s GLU 352 N 0.00 4.41 0.51 1.61 2.12 0.43 -5.03 118.70 122.76 1xlj s GLU 352 Ca 0.00 2.02 0.07 0.00 0.36 0.00 0.00 54.97 57.42 1xlj s GLU 352 Cb 0.00 -3.19 0.05 0.00 0.26 0.00 0.00 34.13 31.24 1xlj s GLU 352 CO 0.00 -0.20 0.70 -1.54 -0.54 0.00 0.00 175.26 173.68 1xlj s SER 353 N 0.20 5.32 0.12 -1.70 1.04 -1.26 -4.81 113.70 112.61 1xlj s SER 353 Ca 0.55 -0.53 -0.20 0.00 0.48 0.00 0.00 55.95 56.25 1xlj s SER 353 Cb -0.36 -0.29 -0.05 0.00 0.10 0.00 0.00 66.02 65.42 1xlj s SER 353 CO 0.39 -1.09 1.74 0.00 0.98 0.00 0.00 173.24 175.25 1xlj h ALA 354 N 0.32 0.17 -0.26 5.32 0.00 -2.00 -2.01 119.26 120.81 1xlj h ALA 354 Ca -0.36 0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.63 1xlj h ALA 354 Cb 1.28 0.04 -0.08 0.00 0.00 0.00 0.00 17.79 19.04 1xlj h ALA 354 CO 0.44 -0.41 -0.50 0.00 0.00 0.00 0.00 179.25 178.78 1xlj h ALA 355 N 1.13 -0.71 -0.14 0.00 0.00 -1.99 -0.57 119.26 116.98 1xlj h ALA 355 Ca 0.08 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.02 1xlj h ALA 355 Cb 0.07 0.98 -0.07 0.00 0.00 0.00 0.00 17.79 18.77 1xlj h ALA 355 CO -0.11 -1.00 -0.45 -0.44 0.00 0.00 0.00 179.25 177.25 1xlj h ASP 356 N -0.47 -1.40 -0.47 0.00 3.32 -1.86 -2.31 116.42 113.23 1xlj h ASP 356 Ca 0.07 0.18 0.04 0.00 0.02 0.00 0.00 57.03 57.35 1xlj h ASP 356 Cb 0.63 0.57 -0.04 0.00 0.22 0.00 0.00 39.33 40.71 1xlj h ASP 356 CO -0.50 -0.44 0.22 0.25 -1.72 0.00 0.00 179.24 177.05 1xlj h LEU 357 N -0.51 0.31 -0.51 1.55 5.85 -1.07 -1.54 115.31 119.40 1xlj h LEU 357 Ca 0.07 0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.90 1xlj h LEU 357 Cb 0.64 -0.02 -0.10 0.00 0.37 0.00 0.00 40.66 41.54 1xlj h LEU 357 CO -0.41 0.22 -0.41 0.24 -0.34 0.00 0.00 178.44 177.74 1xlj h MET 358 N 0.45 -0.24 -0.03 1.25 2.86 -0.70 -2.18 114.93 116.33 1xlj h MET 358 Ca 0.21 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.87 1xlj h MET 358 Cb 0.14 0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.85 1xlj h MET 358 CO -0.16 -0.16 0.00 0.27 1.06 0.00 0.00 176.91 177.92 1xlj n ASN 359 N -5.41 0.26 -4.47 1.22 2.04 -0.90 -4.71 115.26 103.29 1xlj n ASN 359 Ca 0.01 -1.57 -0.43 0.00 -0.44 0.00 0.00 54.58 52.15 1xlj n ASN 359 Cb 0.35 -0.02 -0.05 0.00 -2.53 0.00 0.00 39.78 37.53 1xlj n ASN 359 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 1xlj s ASP 360 N -1.47 6.25 0.32 0.53 2.15 -0.60 -4.95 116.67 118.90 1xlj s ASP 360 Ca 0.24 -0.77 0.07 0.00 0.43 0.00 0.00 52.55 52.51 1xlj s ASP 360 Cb 0.11 -2.38 0.74 0.00 -0.30 0.00 0.00 42.92 41.10 1xlj s ASP 360 CO 0.18 -1.18 1.82 -1.28 -0.17 0.00 0.00 175.17 174.54 1xlj h SER 361 N 9.28 0.76 0.42 -0.34 0.87 -1.85 -2.17 113.55 120.52 1xlj h SER 361 Ca -0.27 0.07 -0.10 0.00 -1.23 0.00 0.00 61.79 60.25 1xlj h SER 361 Cb 1.08 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.95 1xlj h SER 361 CO 1.08 0.33 -0.47 0.00 -0.53 0.00 0.00 176.83 177.24 1xlj h ALA 362 N 1.60 1.17 0.00 6.23 0.00 -1.92 0.96 119.26 127.30 1xlj h ALA 362 Ca 0.52 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1xlj h ALA 362 Cb 0.79 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1xlj h ALA 362 CO -0.29 0.60 -0.14 0.77 0.00 0.00 0.00 179.25 180.18 1xlj h SER 363 N 0.06 0.00 0.00 0.00 0.02 -1.71 -3.26 113.55 108.65 1xlj h SER 363 Ca 0.00 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 1xlj h SER 363 Cb 0.85 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.39 1xlj h SER 363 CO 0.06 0.02 0.00 0.33 -1.14 0.00 0.00 176.83 176.11 1xlj n PHE 364 N -2.33 0.00 -0.22 3.45 7.35 -1.18 -4.80 117.46 119.73 1xlj n PHE 364 Ca 0.05 0.00 -0.03 0.00 -0.76 0.00 0.00 57.45 56.71 1xlj n PHE 364 Cb 0.45 0.00 0.03 0.00 0.35 0.00 0.00 39.48 40.31 1xlj n PHE 364 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1xlj h ALA 365 N 0.67 0.13 -0.14 3.13 0.00 -1.76 -1.26 119.26 120.02 1xlj h ALA 365 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1xlj h ALA 365 Cb 0.00 0.70 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1xlj h ALA 365 CO 0.00 -0.59 0.00 0.41 0.00 0.00 0.00 179.25 179.07 1xlj n GLY 366 N -1.45 -0.08 3.75 0.00 0.00 0.33 -4.97 105.19 102.77 1xlj n GLY 366 Ca 0.06 -0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 1xlj n GLY 366 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1xlj s PHE 367 N -1.82 3.44 -0.62 1.61 5.36 -0.48 -4.81 117.98 120.66 1xlj s PHE 367 Ca 0.27 1.57 -0.12 0.00 -0.96 0.00 0.00 56.93 57.69 1xlj s PHE 367 Cb 0.14 -3.40 0.16 0.00 -0.34 0.00 0.00 43.02 39.58 1xlj s PHE 367 CO 0.21 -0.99 0.53 0.34 -1.46 0.00 0.00 175.22 173.86 1xlj s ASP 368 N -0.51 6.11 0.12 6.13 2.15 -1.26 -4.87 116.67 124.54 1xlj s ASP 368 Ca 0.48 -2.24 -0.18 0.00 0.43 0.00 0.00 52.55 51.04 1xlj s ASP 368 Cb -0.34 -2.11 -0.04 0.00 -0.30 0.00 0.00 42.92 40.13 1xlj s ASP 368 CO 0.42 -0.66 1.68 0.00 -0.17 0.00 0.00 175.17 176.44 1xlj h ALA 369 N 8.18 0.39 -0.45 3.66 0.00 -1.95 -0.32 119.26 128.77 1xlj h ALA 369 Ca -0.11 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1xlj h ALA 369 Cb 1.05 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1xlj h ALA 369 CO 0.86 -0.03 0.30 0.93 0.00 0.00 0.00 179.25 181.31 1xlj h GLU 370 N 0.35 0.60 0.16 0.00 4.39 -1.98 0.19 114.58 118.30 1xlj h GLU 370 Ca 0.10 -0.04 -0.25 0.00 0.34 0.00 0.00 59.36 59.51 1xlj h GLU 370 Cb 0.14 -0.13 0.03 0.00 -0.10 0.00 0.00 28.75 28.68 1xlj h GLU 370 CO -0.01 0.40 -1.09 0.00 -1.16 0.00 0.00 179.01 177.15 1xlj h ALA 371 N 1.71 -0.09 -0.60 3.43 0.00 -1.82 -3.31 119.26 118.59 1xlj h ALA 371 Ca 0.17 -0.75 0.03 0.00 0.00 0.00 0.00 54.91 54.36 1xlj h ALA 371 Cb -0.07 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 1xlj h ALA 371 CO -0.04 0.53 0.35 0.00 0.00 0.00 0.00 179.25 180.10 1xlj h ALA 372 N 0.16 0.78 0.00 0.00 0.00 -0.56 -1.55 119.26 118.10 1xlj h ALA 372 Ca -0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1xlj h ALA 372 Cb 1.83 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1xlj h ALA 372 CO 0.21 0.07 0.08 0.00 0.00 0.00 0.00 179.25 179.60 1xlj n ALA 373 N -2.31 0.90 0.05 0.00 0.00 0.62 -2.31 120.51 117.46 1xlj n ALA 373 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.48 1xlj n ALA 373 Cb 0.10 -0.76 -0.07 0.00 0.00 0.00 0.00 19.45 18.72 1xlj n ALA 373 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1xlj h GLU 374 N 0.00 0.00 -5.57 0.00 4.39 -1.40 -3.48 114.58 108.52 1xlj h GLU 374 Ca 0.00 0.00 -0.71 0.00 0.34 0.00 0.00 59.36 58.99 1xlj h GLU 374 Cb 0.15 0.00 0.06 0.00 -0.10 0.00 0.00 28.75 28.86 1xlj h GLU 374 CO 0.00 0.42 -0.08 -2.13 -1.16 0.00 0.00 179.01 176.05 1xlj n ARG 375 N -3.01 0.00 -3.22 2.33 0.63 -0.98 -4.90 116.66 107.51 1xlj n ARG 375 Ca -0.08 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 56.43 1xlj n ARG 375 Cb 0.86 -1.27 -0.08 0.00 0.45 0.00 0.00 32.46 32.42 1xlj n ARG 375 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1xlj s ASN 376 N -0.24 6.27 0.31 6.15 2.47 -1.26 -4.93 114.94 123.71 1xlj s ASN 376 Ca 0.78 -0.42 0.16 0.00 0.42 0.00 0.00 52.86 53.80 1xlj s ASN 376 Cb -1.10 -2.27 0.38 0.00 -1.45 0.00 0.00 41.25 36.81 1xlj s ASN 376 CO 0.53 -0.64 1.59 -0.26 -3.72 0.00 0.00 177.10 174.60 1xlj h PHE 377 N 8.74 0.00 -5.61 0.43 0.04 -1.90 -3.46 116.94 115.18 1xlj h PHE 377 Ca -0.26 0.00 -0.33 0.00 2.80 0.00 0.00 57.97 60.18 1xlj h PHE 377 Cb 1.11 0.00 0.17 0.00 2.20 0.00 0.00 35.95 39.42 1xlj h PHE 377 CO 0.68 0.50 -0.76 0.00 -0.60 0.00 0.00 178.31 178.14 1xlj n ALA 378 N -2.29 -1.97 0.08 2.45 0.00 -1.26 -3.63 120.51 113.89 1xlj n ALA 378 Ca 0.00 -0.04 -0.08 0.00 0.00 0.00 0.00 53.44 53.32 1xlj n ALA 378 Cb 0.63 -2.50 -0.05 0.00 0.00 0.00 0.00 19.45 17.54 1xlj n ALA 378 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1xlj h PHE 379 N -1.90 0.17 0.07 0.00 0.04 -1.96 -2.81 116.94 110.55 1xlj h PHE 379 Ca -0.58 -0.10 -0.00 0.00 2.80 0.00 0.00 57.97 60.08 1xlj h PHE 379 Cb 1.34 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.47 1xlj h PHE 379 CO 0.44 0.98 -0.03 0.82 -0.60 0.00 0.00 178.31 179.91 1xlj h ILE 380 N 0.05 1.04 -0.19 -0.55 2.04 -1.99 0.26 117.51 118.17 1xlj h ILE 380 Ca -0.04 -0.38 0.01 0.00 1.00 0.00 0.00 64.86 65.45 1xlj h ILE 380 Cb 1.61 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 38.97 1xlj h ILE 380 CO 0.13 0.09 0.11 -0.09 0.00 0.00 0.00 178.15 178.40 1xlj h ARG 381 N -0.27 0.22 -0.79 2.37 2.43 -1.96 -0.93 114.38 115.45 1xlj h ARG 381 Ca -0.01 -0.01 0.10 0.00 -0.81 0.00 0.00 59.98 59.25 1xlj h ARG 381 Cb 0.23 -0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 29.65 1xlj h ARG 381 CO 0.02 0.15 0.43 1.25 -1.51 0.00 0.00 179.97 180.30 1xlj h LEU 382 N 0.23 0.59 -0.36 3.80 5.85 -1.35 -1.64 115.31 122.42 1xlj h LEU 382 Ca 0.07 0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.79 1xlj h LEU 382 Cb -0.00 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 1xlj h LEU 382 CO -0.04 0.32 -0.04 -1.13 -0.34 0.00 0.00 178.44 177.22 1xlj h ASN 383 N 0.71 0.65 -0.82 1.25 -1.24 0.22 -2.84 115.58 113.51 1xlj h ASN 383 Ca 0.39 -0.33 0.13 0.00 0.71 0.00 0.00 56.30 57.20 1xlj h ASN 383 Cb 0.41 -0.18 -0.09 0.00 0.73 0.00 0.00 38.32 39.19 1xlj h ASN 383 CO -0.27 0.83 0.42 -0.61 -1.29 0.00 0.00 177.43 176.51 1xlj h GLN 384 N 0.46 0.63 -0.72 6.67 5.75 -0.51 -1.68 115.11 125.71 1xlj h GLN 384 Ca 0.10 -0.04 -0.06 0.00 -0.15 0.00 0.00 58.65 58.49 1xlj h GLN 384 Cb 0.52 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 28.90 1xlj h GLN 384 CO 0.03 0.41 0.19 -0.07 -2.65 0.00 0.00 178.83 176.74 1xlj h LEU 385 N 0.64 1.07 -0.47 -2.39 3.38 -1.24 -1.20 115.31 115.10 1xlj h LEU 385 Ca 0.43 -0.22 -0.08 0.00 0.09 0.00 0.00 57.88 58.09 1xlj h LEU 385 Cb 0.55 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1xlj h LEU 385 CO -0.33 1.01 -0.04 0.00 0.09 0.00 0.00 178.44 179.18 1xlj h ALA 386 N 1.10 0.63 -0.52 1.53 0.00 -1.08 -2.15 119.26 118.77 1xlj h ALA 386 Ca 0.23 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 1xlj h ALA 386 Cb 0.35 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1xlj h ALA 386 CO -0.00 0.47 -0.10 0.82 0.00 0.00 0.00 179.25 180.44 1xlj h ILE 387 N 0.70 1.27 -0.55 0.00 1.08 -1.29 0.74 117.51 119.46 1xlj h ILE 387 Ca 0.13 -1.24 -0.04 0.00 -0.39 0.00 0.00 64.86 63.32 1xlj h ILE 387 Cb 0.56 1.01 -0.03 0.00 -3.07 0.00 0.00 36.82 35.30 1xlj h ILE 387 CO 0.03 0.44 0.19 -0.33 -0.69 0.00 0.00 178.15 177.78 1xlj h GLU 388 N 0.84 0.82 -0.29 2.37 5.08 -1.18 0.30 114.58 122.52 1xlj h GLU 388 Ca 0.13 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1xlj h GLU 388 Cb 0.66 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1xlj h GLU 388 CO 0.05 0.70 0.03 0.45 -1.00 0.00 0.00 179.01 179.23 1xlj h HIS 389 N 0.80 0.52 -0.75 4.33 3.86 -0.98 -2.43 115.15 120.49 1xlj h HIS 389 Ca 0.19 -0.08 -0.06 0.00 -1.16 0.00 0.00 60.37 59.26 1xlj h HIS 389 Cb 0.21 -0.14 -0.03 0.00 1.06 0.00 0.00 27.41 28.51 1xlj h HIS 389 CO 0.01 0.60 0.25 1.25 0.86 0.00 0.00 177.93 180.90 1xlj h LEU 390 N 0.30 1.09 0.00 2.43 5.85 -0.21 -2.90 115.31 121.87 1xlj h LEU 390 Ca 0.09 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.60 1xlj h LEU 390 Cb 0.37 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.11 1xlj h LEU 390 CO 0.01 1.00 0.00 0.18 -0.34 0.00 0.00 178.44 179.29 1xlj n LEU 391 N -4.26 0.00 -0.32 2.25 4.77 0.99 -4.89 117.00 115.54 1xlj n LEU 391 Ca 0.06 0.35 -0.04 0.00 -0.03 0.00 0.00 56.01 56.35 1xlj n LEU 391 Cb 0.22 -0.35 -0.02 0.00 -2.33 0.00 0.00 43.42 40.95 1xlj n LEU 391 CO 0.42 -0.14 -0.04 0.61 -1.33 0.00 0.00 177.39 176.90 1xlj n GLY 392 N 0.25 0.70 0.10 -0.72 0.00 -1.09 -4.93 105.19 99.50 1xlj n GLY 392 Ca 0.07 -0.60 -0.15 0.00 0.00 0.00 0.00 46.02 45.35 1xlj n GLY 392 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1xlj h SER 393 N 0.00 0.27 -0.00 1.61 0.87 -1.68 -3.49 113.55 111.12 1xlj h SER 393 Ca -0.09 -0.72 0.00 0.00 -1.23 0.00 0.00 61.79 59.75 1xlj h SER 393 Cb 0.34 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.22 1xlj h SER 393 CO 0.13 0.95 0.00 0.54 -0.53 0.00 0.00 176.83 177.92