#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xlj s GLN 3 N 0.00 0.72 0.43 7.34 -1.52 -1.26 -4.93 119.66 120.45 1xlj s GLN 3 Ca 0.00 0.03 -0.23 0.00 -1.95 0.00 0.00 55.36 53.21 1xlj s GLN 3 Cb 0.00 -0.98 -0.09 0.00 -0.22 0.00 0.00 33.01 31.73 1xlj s GLN 3 CO 0.00 -0.25 1.06 -1.25 -0.25 0.00 0.00 175.29 174.60 1xlj s PRO 4 N 1.68 4.00 0.09 2.91 0.04 -1.26 -5.06 135.00 137.40 1xlj s PRO 4 Ca 0.01 1.50 0.03 0.00 0.04 0.00 0.00 61.00 62.57 1xlj s PRO 4 Cb -0.13 -2.38 -0.04 0.00 0.04 0.00 0.00 34.50 32.00 1xlj s PRO 4 CO -0.04 -0.29 -0.09 0.95 0.04 0.00 0.00 177.00 177.57 1xlj s THR 5 N -1.75 0.81 0.64 1.26 -4.23 -1.26 -4.67 115.64 106.44 1xlj s THR 5 Ca 0.62 -1.62 0.19 0.00 -1.18 0.00 0.00 61.69 59.69 1xlj s THR 5 Cb -0.21 -1.32 0.24 0.00 1.34 0.00 0.00 72.50 72.55 1xlj s THR 5 CO 0.26 -0.61 1.48 -0.65 -0.54 0.00 0.00 174.62 174.55 1xlj h PRO 6 N 3.56 0.00 0.00 3.99 0.11 -1.82 0.26 132.00 138.10 1xlj h PRO 6 Ca -0.36 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.68 1xlj h PRO 6 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1xlj h PRO 6 CO 0.54 0.00 -0.29 0.00 -0.21 0.00 0.00 178.00 178.04 1xlj h ALA 7 N 0.74 1.43 -0.01 -0.75 0.00 -1.96 -2.95 119.26 115.76 1xlj h ALA 7 Ca 0.15 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 1xlj h ALA 7 Cb 1.70 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.43 1xlj h ALA 7 CO -0.00 0.36 -0.63 -0.44 0.00 0.00 0.00 179.25 178.54 1xlj h ASP 8 N 0.00 0.04 -4.07 0.00 3.32 -0.85 -3.48 116.42 111.38 1xlj h ASP 8 Ca -0.00 -0.02 -0.24 0.00 0.02 0.00 0.00 57.03 56.78 1xlj h ASP 8 Cb 0.54 -0.01 0.09 0.00 0.22 0.00 0.00 39.33 40.17 1xlj h ASP 8 CO 0.04 0.66 -0.43 1.41 -1.72 0.00 0.00 179.24 179.19 1xlj n HIS 9 N -3.80 -1.75 -2.80 4.55 8.25 -1.12 -4.72 115.22 113.82 1xlj n HIS 9 Ca -0.01 0.63 -0.42 0.00 -0.26 0.00 0.00 57.72 57.66 1xlj n HIS 9 Cb 0.62 -3.59 -0.03 0.00 1.12 0.00 0.00 29.99 28.11 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 -3.20 3.31 0.16 4.41 0.08 -1.26 -1.30 117.98 120.18 1xlj s PHE 10 Ca 0.32 1.23 0.10 0.00 0.12 0.00 0.00 56.93 58.71 1xlj s PHE 10 Cb -0.14 -3.16 -0.04 0.00 -0.57 0.00 0.00 43.02 39.11 1xlj s PHE 10 CO 0.46 -0.45 -0.21 0.95 -0.10 0.00 0.00 175.22 175.87 1xlj s THR 11 N 3.01 2.60 0.04 0.64 -4.23 -0.77 -0.19 115.64 116.73 1xlj s THR 11 Ca 0.38 -1.78 0.02 0.00 -1.18 0.00 0.00 61.69 59.13 1xlj s THR 11 Cb -0.15 -2.22 -0.02 0.00 1.34 0.00 0.00 72.50 71.45 1xlj s THR 11 CO 0.07 -0.02 -0.07 -0.36 -0.54 0.00 0.00 174.62 173.71 1xlj s PHE 12 N -1.41 0.58 0.25 3.99 0.40 -0.94 -2.28 117.98 118.56 1xlj s PHE 12 Ca 0.19 -0.50 -0.12 0.00 -0.60 0.00 0.00 56.93 55.90 1xlj s PHE 12 Cb -0.09 -0.35 -0.08 0.00 0.51 0.00 0.00 43.02 43.01 1xlj s PHE 12 CO 0.10 -0.11 0.62 0.20 0.70 0.00 0.00 175.22 176.74 1xlj s GLY 13 N -1.52 2.33 0.36 4.36 0.00 -1.25 -0.21 107.32 111.38 1xlj s GLY 13 Ca -0.11 -0.13 0.04 0.00 0.00 0.00 0.00 44.72 44.52 1xlj s GLY 13 CO 0.00 0.06 1.96 -2.00 0.00 0.00 0.00 173.10 173.12 1xlj h LEU 14 N 2.58 0.58 -0.57 0.66 5.85 -1.24 -2.17 115.31 121.00 1xlj h LEU 14 Ca -0.47 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.19 1xlj h LEU 14 Cb 1.17 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.06 1xlj h LEU 14 CO 0.67 0.51 0.00 4.11 -0.34 0.00 0.00 178.44 183.39 1xlj h TRP 15 N 0.65 0.00 0.01 1.25 0.09 -1.90 -1.76 115.95 114.29 1xlj h TRP 15 Ca 0.16 0.00 -0.00 0.00 0.09 0.00 0.00 58.89 59.14 1xlj h TRP 15 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.33 1xlj h TRP 15 CO 0.01 0.00 -0.01 1.79 0.09 0.00 0.00 178.44 180.32 1xlj h THR 16 N 0.00 0.00 0.00 0.12 1.35 -1.60 -2.55 112.91 110.23 1xlj h THR 16 Ca 0.00 -0.36 -0.04 0.00 -0.55 0.00 0.00 66.41 65.45 1xlj h THR 16 Cb 0.47 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 66.89 1xlj h THR 16 CO 0.00 0.00 -0.20 -0.37 -0.25 0.00 0.00 175.52 174.70 1xlj h VAL 17 N -0.38 0.64 0.00 6.82 -1.51 -1.71 -2.35 116.25 117.77 1xlj h VAL 17 Ca -0.00 -0.89 0.00 0.00 -1.23 0.00 0.00 66.70 64.58 1xlj h VAL 17 Cb 0.01 1.57 0.00 0.00 -2.13 0.00 0.00 31.29 30.74 1xlj h VAL 17 CO 0.00 0.20 0.00 0.61 -1.23 0.00 0.00 177.57 177.15 1xlj n GLY 18 N -0.29 -1.44 3.65 5.19 0.00 -0.66 -4.80 105.19 106.84 1xlj n GLY 18 Ca -0.01 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.06 1.83 -0.76 1.61 -0.00 -0.88 -4.65 118.94 113.04 1xlj s TRP 19 Ca 0.11 0.17 0.26 0.00 -0.00 0.00 0.00 56.10 56.64 1xlj s TRP 19 Cb 0.15 -3.99 0.68 0.00 -0.00 0.00 0.00 33.47 30.31 1xlj s TRP 19 CO 0.48 -3.98 1.61 2.41 -0.00 0.00 0.00 176.95 177.48 1xlj n THR 20 N 5.82 0.39 0.00 5.86 -1.04 -1.26 -4.80 114.28 119.25 1xlj n THR 20 Ca 0.19 -0.22 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 1xlj n THR 20 Cb 0.43 -0.35 0.00 0.00 -1.82 0.00 0.00 70.33 68.59 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 1.36 0.52 3.74 3.41 0.00 -1.26 -0.38 105.19 112.58 1xlj n GLY 21 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 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 3.38 0.15 4.61 0.00 -1.26 -4.42 121.76 122.21 1xlj s ALA 22 Ca 0.00 0.82 0.02 0.00 0.00 0.00 0.00 51.96 52.80 1xlj s ALA 22 Cb 0.00 -3.34 -0.01 0.00 0.00 0.00 0.00 23.12 19.77 1xlj s ALA 22 CO 0.00 -0.18 0.08 -0.40 0.00 0.00 0.00 175.76 175.26 1xlj n ASP 23 N 2.09 0.47 -0.02 0.00 5.68 -0.45 -4.94 116.55 119.39 1xlj n ASP 23 Ca 0.02 -1.85 0.15 0.00 -0.50 0.00 0.00 54.79 52.61 1xlj n ASP 23 Cb 0.46 0.51 0.59 0.00 -1.14 0.00 0.00 41.12 41.54 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 0.20 -0.20 0.11 0.11 -2.01 -3.08 132.00 127.13 1xlj h PRO 24 Ca -0.11 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.99 1xlj h PRO 24 Cb 0.47 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.53 1xlj h PRO 24 CO 0.17 0.13 0.00 1.19 -0.21 0.00 0.00 178.00 179.28 1xlj n PHE 25 N -4.44 0.54 -3.60 0.65 3.72 -1.26 -5.07 117.46 108.00 1xlj n PHE 25 Ca 0.09 -0.78 -0.06 0.00 -0.05 0.00 0.00 57.45 56.65 1xlj n PHE 25 Cb 0.44 -0.19 -0.02 0.00 -0.94 0.00 0.00 39.48 38.77 1xlj n PHE 25 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1xlj s GLY 26 N -1.82 -0.37 0.60 1.37 0.00 -1.17 -5.17 107.32 100.76 1xlj s GLY 26 Ca 0.31 0.77 -0.03 0.00 0.00 0.00 0.00 44.72 45.77 1xlj s GLY 26 CO 0.08 0.23 0.88 -1.34 0.00 0.00 0.00 173.10 172.95 1xlj s VAL 27 N -3.06 3.00 0.44 1.40 -7.23 -1.26 -1.34 120.40 112.35 1xlj s VAL 27 Ca 0.08 -0.32 -0.23 0.00 -1.81 0.00 0.00 61.98 59.70 1xlj s VAL 27 Cb -0.01 -3.20 -0.11 0.00 0.56 0.00 0.00 36.38 33.63 1xlj s VAL 27 CO -0.05 -0.18 0.87 0.00 -0.31 0.00 0.00 175.10 175.43 1xlj n ALA 28 N -2.57 -0.33 0.44 1.32 0.00 -1.26 -4.22 120.51 113.90 1xlj n ALA 28 Ca 0.06 0.19 0.05 0.00 0.00 0.00 0.00 53.44 53.74 1xlj n ALA 28 Cb 0.59 -1.99 -0.06 0.00 0.00 0.00 0.00 19.45 17.99 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 -0.73 0.00 -4.37 0.00 -2.24 0.49 -4.86 114.28 102.57 1xlj n THR 29 Ca 0.10 -0.26 -0.22 0.00 -2.27 0.00 0.00 64.05 61.40 1xlj n THR 29 Cb 0.40 0.94 -0.11 0.00 -2.10 0.00 0.00 70.33 69.46 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 -2.02 1.37 0.52 -0.78 0.52 -0.91 -5.03 118.95 112.61 1xlj s ARG 30 Ca 0.03 -1.50 -0.10 0.00 -0.52 0.00 0.00 55.73 53.64 1xlj s ARG 30 Cb 0.08 -1.43 -0.05 0.00 0.52 0.00 0.00 34.95 34.07 1xlj s ARG 30 CO 0.42 0.28 0.90 -1.59 0.02 0.00 0.00 175.30 175.33 1xlj s LYS 31 N -3.00 3.68 0.57 3.54 0.00 -1.26 -4.83 119.74 118.43 1xlj s LYS 31 Ca 0.19 0.57 -0.21 0.00 0.00 0.00 0.00 55.97 56.52 1xlj s LYS 31 Cb -0.05 -2.24 -0.04 0.00 0.00 0.00 0.00 37.83 35.50 1xlj s LYS 31 CO 0.08 -0.31 1.35 -0.80 0.00 0.00 0.00 175.35 175.67 1xlj s ASN 32 N -3.77 5.13 -0.22 0.03 -0.87 -1.26 -4.91 114.94 109.07 1xlj s ASN 32 Ca 0.53 2.74 -0.14 0.00 -1.57 0.00 0.00 52.86 54.42 1xlj s ASN 32 Cb -0.10 -2.63 -0.04 0.00 -0.02 0.00 0.00 41.25 38.45 1xlj s ASN 32 CO 0.43 -1.66 0.32 -0.22 -2.57 0.00 0.00 177.10 173.40 1xlj s LEU 33 N -3.70 4.14 0.24 0.60 2.96 -1.26 -5.06 118.68 116.60 1xlj s LEU 33 Ca 0.74 0.38 -0.30 0.00 -0.22 0.00 0.00 54.13 54.73 1xlj s LEU 33 Cb -0.40 -2.38 -0.09 0.00 0.50 0.00 0.00 46.19 43.82 1xlj s LEU 33 CO 0.46 -0.04 1.26 -0.62 -1.32 0.00 0.00 176.35 176.09 1xlj s ASP 34 N 1.08 6.95 0.28 3.68 -1.08 -1.26 -4.93 116.67 121.40 1xlj s ASP 34 Ca 0.15 2.42 -0.01 0.00 -0.52 0.00 0.00 52.55 54.60 1xlj s ASP 34 Cb -0.14 -2.62 0.47 0.00 -1.46 0.00 0.00 42.92 39.16 1xlj s ASP 34 CO 0.07 -0.45 1.90 -0.65 0.52 0.00 0.00 175.17 176.56 1xlj h PRO 35 N 4.67 1.08 0.05 4.34 0.11 -1.97 -1.98 132.00 138.30 1xlj h PRO 35 Ca -0.46 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 65.59 1xlj h PRO 35 Cb 1.22 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.07 1xlj h PRO 35 CO 0.73 0.71 -0.07 0.28 -0.21 0.00 0.00 178.00 179.43 1xlj h VAL 36 N 1.11 0.82 -0.42 3.15 2.07 -1.91 -1.84 116.25 119.22 1xlj h VAL 36 Ca 0.41 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.88 1xlj h VAL 36 Cb 0.17 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 1xlj h VAL 36 CO -0.15 0.00 0.05 -0.08 0.02 0.00 0.00 177.57 177.41 1xlj h GLU 37 N -0.15 0.65 -0.08 1.57 4.81 -1.84 -2.74 114.58 116.80 1xlj h GLU 37 Ca 0.01 -0.14 0.03 0.00 -0.13 0.00 0.00 59.36 59.13 1xlj h GLU 37 Cb 0.16 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 1xlj h GLU 37 CO -0.04 0.64 -0.09 0.00 -0.73 0.00 0.00 179.01 178.79 1xlj h ALA 38 N 1.43 -0.03 -0.32 2.92 0.00 -0.90 0.40 119.26 122.78 1xlj h ALA 38 Ca 0.14 0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.13 1xlj h ALA 38 Cb 0.31 0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 1xlj h ALA 38 CO 0.01 -0.56 0.07 0.28 0.00 0.00 0.00 179.25 179.05 1xlj h VAL 39 N -0.12 0.86 -0.01 0.00 2.07 -1.22 -1.57 116.25 116.27 1xlj h VAL 39 Ca 0.06 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 1xlj h VAL 39 Cb 0.21 0.65 -0.00 0.00 -1.52 0.00 0.00 31.29 30.63 1xlj h VAL 39 CO -0.15 0.04 -0.00 0.45 0.02 0.00 0.00 177.57 177.92 1xlj h HIS 40 N 0.19 0.02 -0.62 1.57 -0.00 -1.33 -2.16 115.15 112.83 1xlj h HIS 40 Ca 0.15 -0.01 0.02 0.00 -0.00 0.00 0.00 60.37 60.54 1xlj h HIS 40 Cb 0.15 -0.01 -0.04 0.00 -0.00 0.00 0.00 27.41 27.52 1xlj h HIS 40 CO -0.17 0.42 0.39 -0.22 -0.00 0.00 0.00 177.93 178.35 1xlj h LYS 41 N -0.38 0.74 -0.51 2.45 1.63 -0.85 -1.21 116.57 118.44 1xlj h LYS 41 Ca 0.00 -0.04 -0.11 0.00 -0.85 0.00 0.00 60.65 59.64 1xlj h LYS 41 Cb 0.41 -0.17 -0.02 0.00 -0.60 0.00 0.00 32.23 31.86 1xlj h LYS 41 CO 0.00 0.49 -0.13 -0.07 -3.45 0.00 0.00 179.45 176.29 1xlj h LEU 42 N 0.76 0.98 -0.44 5.20 3.38 -1.33 -2.13 115.31 121.72 1xlj h LEU 42 Ca 0.24 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 1xlj h LEU 42 Cb 0.00 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 1xlj h LEU 42 CO -0.09 1.10 0.14 0.00 0.09 0.00 0.00 178.44 179.68 1xlj h ALA 43 N 0.98 0.58 -0.95 1.53 0.00 -1.07 -1.35 119.26 118.98 1xlj h ALA 43 Ca 0.13 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 54.93 1xlj h ALA 43 Cb 0.68 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.24 1xlj h ALA 43 CO 0.05 0.22 0.62 0.93 0.00 0.00 0.00 179.25 181.07 1xlj h GLU 44 N 0.58 1.09 0.00 0.00 5.08 -1.06 -2.45 114.58 117.82 1xlj h GLU 44 Ca 0.14 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1xlj h GLU 44 Cb 0.25 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1xlj h GLU 44 CO -0.01 0.72 0.00 -0.07 -1.00 0.00 0.00 179.01 178.66 1xlj h LEU 45 N 1.12 0.00 0.00 1.33 3.38 -0.77 -3.46 115.31 116.90 1xlj h LEU 45 Ca 0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.37 1xlj h LEU 45 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1xlj h LEU 45 CO -0.15 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.99 1xlj n GLY 46 N 0.26 0.91 3.58 0.83 0.00 -0.92 -4.73 105.19 105.11 1xlj n GLY 46 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 1xlj n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xlj n ALA 47 N -0.54 -0.42 -0.11 4.61 0.00 -0.57 -3.64 120.51 119.83 1xlj n ALA 47 Ca 0.00 -0.15 -0.25 0.00 0.00 0.00 0.00 53.44 53.05 1xlj n ALA 47 Cb 0.00 -2.05 -0.11 0.00 0.00 0.00 0.00 19.45 17.29 1xlj n ALA 47 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1xlj n TYR 48 N -2.27 0.50 -3.98 0.00 9.36 0.73 -4.64 117.16 116.85 1xlj n TYR 48 Ca 0.13 0.19 -0.09 0.00 3.32 0.00 0.00 57.90 61.44 1xlj n TYR 48 Cb 0.49 -1.05 -0.04 0.00 -0.63 0.00 0.00 39.34 38.10 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 -5.38 0.57 0.12 2.98 0.00 -1.15 -2.77 107.32 101.70 1xlj s GLY 49 Ca -0.33 -0.89 0.08 0.00 0.00 0.00 0.00 44.72 43.59 1xlj s GLY 49 CO 0.57 -0.59 -0.21 -1.50 0.00 0.00 0.00 173.10 171.37 1xlj s ILE 50 N -3.76 1.78 0.19 0.90 2.07 -0.76 -2.22 121.20 119.39 1xlj s ILE 50 Ca 0.22 -1.63 0.02 0.00 -1.41 0.00 0.00 60.65 57.85 1xlj s ILE 50 Cb -0.02 -1.64 -0.05 0.00 0.13 0.00 0.00 42.46 40.88 1xlj s ILE 50 CO 0.10 -0.10 0.00 0.42 -1.91 0.00 0.00 174.94 173.46 1xlj s THR 51 N -1.32 0.77 0.20 4.00 -4.23 0.71 -3.96 115.64 111.81 1xlj s THR 51 Ca 0.09 -2.00 -0.23 0.00 -1.18 0.00 0.00 61.69 58.37 1xlj s THR 51 Cb -0.09 -2.21 0.05 0.00 1.34 0.00 0.00 72.50 71.59 1xlj s THR 51 CO 0.05 -0.41 0.69 0.72 -0.54 0.00 0.00 174.62 175.13 1xlj s PHE 52 N -3.60 -0.35 0.00 3.99 -0.71 -1.25 -0.59 117.98 115.48 1xlj s PHE 52 Ca 0.26 0.02 -0.06 0.00 -1.04 0.00 0.00 56.93 56.11 1xlj s PHE 52 Cb 0.06 0.63 -0.05 0.00 -1.21 0.00 0.00 43.02 42.45 1xlj s PHE 52 CO 0.06 -1.01 0.26 -1.01 -1.34 0.00 0.00 175.22 172.18 1xlj s HIS 53 N -3.76 3.58 0.22 3.49 3.76 -1.26 -1.49 115.29 119.83 1xlj s HIS 53 Ca 0.06 0.56 -0.17 0.00 -0.15 0.00 0.00 55.06 55.36 1xlj s HIS 53 Cb -0.03 -1.98 0.22 0.00 1.11 0.00 0.00 32.58 31.90 1xlj s HIS 53 CO -0.03 0.62 1.58 0.38 -0.85 0.00 0.00 174.74 176.44 1xlj h ASP 54 N 4.00 -1.16 -0.03 1.40 2.03 -1.69 -0.69 116.42 120.29 1xlj h ASP 54 Ca -0.50 0.26 0.00 0.00 -0.73 0.00 0.00 57.03 56.06 1xlj h ASP 54 Cb 1.20 0.62 0.00 0.00 -0.83 0.00 0.00 39.33 40.32 1xlj h ASP 54 CO 0.66 -0.29 0.00 0.59 -1.03 0.00 0.00 179.24 179.17 1xlj n ASN 55 N -5.47 0.26 -0.04 4.15 5.03 -1.25 -0.90 115.26 117.03 1xlj n ASN 55 Ca 0.08 -1.48 -0.15 0.00 0.87 0.00 0.00 54.58 53.90 1xlj n ASN 55 Cb 0.39 -0.02 -0.08 0.00 -1.02 0.00 0.00 39.78 39.05 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 0.34 0.62 0.00 6.41 3.32 -1.52 -3.39 116.42 122.19 1xlj h ASP 56 Ca 0.00 -0.60 0.00 0.00 0.02 0.00 0.00 57.03 56.45 1xlj h ASP 56 Cb 0.07 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.45 1xlj h ASP 56 CO 0.00 1.11 -0.13 0.25 -1.72 0.00 0.00 179.24 178.75 1xlj h LEU 57 N 0.16 0.00 -8.69 1.55 5.85 -1.60 -3.47 115.31 109.11 1xlj h LEU 57 Ca -0.01 0.00 -0.68 0.00 0.84 0.00 0.00 57.88 58.03 1xlj h LEU 57 Cb 1.05 0.00 -0.18 0.00 0.37 0.00 0.00 40.66 41.90 1xlj h LEU 57 CO 0.09 0.20 -0.36 -0.63 -0.34 0.00 0.00 178.44 177.40 1xlj s ILE 58 N -1.32 5.21 0.62 4.05 1.01 -0.08 -5.04 121.20 125.64 1xlj s ILE 58 Ca -0.04 -0.14 -0.18 0.00 0.00 0.00 0.00 60.65 60.29 1xlj s ILE 58 Cb 0.01 -3.82 -0.06 0.00 0.01 0.00 0.00 42.46 38.60 1xlj s ILE 58 CO 0.06 -0.12 0.66 -2.65 0.00 0.00 0.00 174.94 172.89 1xlj n PRO 59 N 5.29 0.56 -0.19 2.79 -0.02 -1.26 -3.84 135.00 138.33 1xlj n PRO 59 Ca -0.10 0.23 -0.02 0.00 -2.02 0.00 0.00 63.50 61.58 1xlj n PRO 59 Cb 0.49 -1.88 0.08 0.00 -0.02 0.00 0.00 33.50 32.18 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 0.14 0.47 -0.01 6.00 3.04 -1.95 -2.13 116.94 122.49 1xlj h PHE 60 Ca -0.46 0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.51 1xlj h PHE 60 Cb 1.38 -0.12 0.00 0.00 2.56 0.00 0.00 35.95 39.76 1xlj h PHE 60 CO 0.34 0.18 -0.17 -0.40 -2.02 0.00 0.00 178.31 176.24 1xlj n ASP 61 N -4.92 0.96 -4.43 0.41 5.68 -1.26 -5.01 116.55 107.97 1xlj n ASP 61 Ca 0.07 -0.93 -0.49 0.00 -0.50 0.00 0.00 54.79 52.94 1xlj n ASP 61 Cb 0.20 0.06 -0.04 0.00 -1.14 0.00 0.00 41.12 40.21 1xlj n ASP 61 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1xlj n ALA 62 N -0.58 -2.72 -1.93 2.12 0.00 -0.80 -4.98 120.51 111.61 1xlj n ALA 62 Ca 0.14 0.46 -0.28 0.00 0.00 0.00 0.00 53.44 53.75 1xlj n ALA 62 Cb 0.33 -1.67 0.14 0.00 0.00 0.00 0.00 19.45 18.25 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 -0.85 2.05 0.22 0.00 -4.23 -1.26 -4.84 115.64 106.72 1xlj s THR 63 Ca 0.67 -0.10 -0.07 0.00 -1.18 0.00 0.00 61.69 61.01 1xlj s THR 63 Cb -0.95 -2.95 0.17 0.00 1.34 0.00 0.00 72.50 70.10 1xlj s THR 63 CO 0.56 0.00 1.79 1.05 -0.54 0.00 0.00 174.62 177.48 1xlj h GLU 64 N -1.25 1.20 0.11 3.99 9.09 -1.99 -1.21 114.58 124.52 1xlj h GLU 64 Ca -0.44 -0.21 -0.01 0.00 0.05 0.00 0.00 59.36 58.76 1xlj h GLU 64 Cb 1.27 -0.20 0.00 0.00 -1.65 0.00 0.00 28.75 28.17 1xlj h GLU 64 CO 0.48 0.96 -0.05 0.00 0.05 0.00 0.00 179.01 180.45 1xlj h ALA 65 N 1.19 -0.15 -0.54 1.06 0.00 -1.99 -2.10 119.26 116.72 1xlj h ALA 65 Ca 0.27 -0.21 0.10 0.00 0.00 0.00 0.00 54.91 55.07 1xlj h ALA 65 Cb 0.20 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.97 1xlj h ALA 65 CO -0.02 -0.37 0.10 0.93 0.00 0.00 0.00 179.25 179.89 1xlj h GLU 66 N -0.58 0.23 -0.48 0.00 5.08 -1.85 -2.30 114.58 114.68 1xlj h GLU 66 Ca -0.02 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.38 1xlj h GLU 66 Cb 0.46 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.61 1xlj h GLU 66 CO 0.03 0.15 0.21 -0.09 -1.00 0.00 0.00 179.01 178.30 1xlj h ARG 67 N 0.23 0.40 -0.63 2.33 2.43 -1.19 -1.43 114.38 116.52 1xlj h ARG 67 Ca 0.27 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.36 1xlj h ARG 67 Cb 0.39 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.82 1xlj h ARG 67 CO -0.36 0.26 0.16 1.49 -1.51 0.00 0.00 179.97 180.01 1xlj h GLU 68 N 0.41 0.98 0.44 0.20 4.57 -0.88 -1.38 114.58 118.91 1xlj h GLU 68 Ca 0.22 -0.21 -0.02 0.00 -1.18 0.00 0.00 59.36 58.17 1xlj h GLU 68 Cb 0.19 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.64 1xlj h GLU 68 CO -0.19 0.87 -0.21 -0.22 -1.18 0.00 0.00 179.01 178.07 1xlj h LYS 69 N 0.94 -0.56 -0.35 1.92 3.11 -0.98 -1.28 116.57 119.37 1xlj h LYS 69 Ca 0.20 0.04 0.07 0.00 -2.81 0.00 0.00 60.65 58.15 1xlj h LYS 69 Cb 0.32 0.13 -0.07 0.00 -1.00 0.00 0.00 32.23 31.61 1xlj h LYS 69 CO -0.00 -0.28 -0.13 0.82 -2.81 0.00 0.00 179.45 177.05 1xlj h ILE 70 N -0.79 0.56 -0.86 2.00 2.04 -1.23 0.44 117.51 119.68 1xlj h ILE 70 Ca -0.06 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.80 1xlj h ILE 70 Cb 0.54 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 37.14 1xlj h ILE 70 CO 0.10 0.00 0.54 -0.07 0.00 0.00 0.00 178.15 178.72 1xlj h LEU 71 N -0.06 1.01 -0.60 1.44 3.38 -1.22 -1.52 115.31 117.74 1xlj h LEU 71 Ca 0.17 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 58.01 1xlj h LEU 71 Cb 0.32 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1xlj h LEU 71 CO -0.39 0.75 0.02 1.23 0.09 0.00 0.00 178.44 180.14 1xlj h GLY 72 N 1.18 1.12 1.32 0.83 0.00 0.10 0.13 103.07 107.74 1xlj h GLY 72 Ca 0.31 -0.81 -0.19 0.00 0.00 0.00 0.00 47.33 46.65 1xlj h GLY 72 CO -0.06 0.74 -0.62 -0.55 0.00 0.00 0.00 176.54 176.05 1xlj h ASP 73 N 0.93 0.80 -0.15 0.19 3.32 -0.68 -1.68 116.42 119.15 1xlj h ASP 73 Ca 0.17 -0.46 -0.09 0.00 0.02 0.00 0.00 57.03 56.67 1xlj h ASP 73 Cb 0.53 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.85 1xlj h ASP 73 CO 0.03 1.22 -0.27 0.15 -1.72 0.00 0.00 179.24 178.65 1xlj h PHE 74 N 0.52 0.56 0.00 4.55 3.57 -1.08 -2.49 116.94 122.56 1xlj h PHE 74 Ca -0.01 -0.20 -0.06 0.00 3.53 0.00 0.00 57.97 61.24 1xlj h PHE 74 Cb 1.20 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.83 1xlj h PHE 74 CO 0.06 0.90 -0.28 -0.91 -2.23 0.00 0.00 178.31 175.85 1xlj h ASN 75 N 0.06 0.00 0.46 0.41 -0.26 -0.81 -1.42 115.58 114.02 1xlj h ASN 75 Ca 0.01 0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.73 1xlj h ASN 75 Cb 0.86 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.12 1xlj h ASN 75 CO 0.06 0.28 -0.22 -0.61 -1.06 0.00 0.00 177.43 175.88 1xlj h GLN 76 N 0.00 -0.60 -0.50 0.81 5.75 -1.17 -1.92 115.11 117.48 1xlj h GLN 76 Ca -0.00 0.04 0.10 0.00 -0.15 0.00 0.00 58.65 58.64 1xlj h GLN 76 Cb 0.55 0.14 -0.10 0.00 1.07 0.00 0.00 27.48 29.14 1xlj h GLN 76 CO 0.04 -0.31 -0.13 0.00 -2.65 0.00 0.00 178.83 175.78 1xlj h ALA 77 N -0.40 0.33 -0.19 3.38 0.00 -1.12 0.49 119.26 121.74 1xlj h ALA 77 Ca -0.06 0.20 0.02 0.00 0.00 0.00 0.00 54.91 55.07 1xlj h ALA 77 Cb 0.57 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1xlj h ALA 77 CO 0.10 -0.44 0.04 -0.07 0.00 0.00 0.00 179.25 178.89 1xlj h LEU 78 N -0.00 0.02 -0.15 0.00 3.38 -1.29 0.59 115.31 117.86 1xlj h LEU 78 Ca 0.24 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.24 1xlj h LEU 78 Cb 0.37 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1xlj h LEU 78 CO -0.52 0.04 0.09 0.11 0.09 0.00 0.00 178.44 178.25 1xlj h LYS 79 N 0.12 0.21 -0.00 1.13 1.57 -0.24 0.15 116.57 119.51 1xlj h LYS 79 Ca 0.09 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.87 1xlj h LYS 79 Cb 0.08 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 1xlj h LYS 79 CO -0.11 0.20 -0.13 -0.44 -0.57 0.00 0.00 179.45 178.40 1xlj h ASP 80 N 0.16 -0.38 1.16 0.86 3.32 0.25 -3.28 116.42 118.50 1xlj h ASP 80 Ca 0.05 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.13 1xlj h ASP 80 Cb 0.05 0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 1xlj h ASP 80 CO -0.01 -0.19 -0.85 0.71 -1.72 0.00 0.00 179.24 177.18 1xlj h THR 81 N -0.22 0.13 0.00 0.35 1.35 -0.77 -3.49 112.91 110.26 1xlj h THR 81 Ca 0.05 -1.23 0.00 0.00 -0.55 0.00 0.00 66.41 64.68 1xlj h THR 81 Cb 0.28 1.73 0.00 0.00 -1.73 0.00 0.00 68.15 68.43 1xlj h THR 81 CO -0.13 0.07 0.00 0.61 -0.25 0.00 0.00 175.52 175.82 1xlj n GLY 82 N 1.20 0.57 3.76 5.82 0.00 0.51 -5.02 105.19 112.04 1xlj n GLY 82 Ca -0.01 -0.17 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 1xlj n GLY 82 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xlj s LEU 83 N 0.00 4.05 0.29 0.99 2.96 -1.18 -5.02 118.68 120.76 1xlj s LEU 83 Ca 0.00 2.58 0.05 0.00 -0.22 0.00 0.00 54.13 56.54 1xlj s LEU 83 Cb 0.00 -4.11 -0.02 0.00 0.50 0.00 0.00 46.19 42.56 1xlj s LEU 83 CO 0.00 -1.08 0.42 -0.75 -1.32 0.00 0.00 176.35 173.62 1xlj s LYS 84 N -2.57 3.32 -0.58 1.98 2.47 -1.11 -4.84 119.74 118.41 1xlj s LYS 84 Ca 0.63 -0.81 0.04 0.00 -1.56 0.00 0.00 55.97 54.27 1xlj s LYS 84 Cb -0.36 -2.84 0.15 0.00 -1.46 0.00 0.00 37.83 33.32 1xlj s LYS 84 CO 0.44 0.26 0.37 0.08 0.16 0.00 0.00 175.35 176.67 1xlj s VAL 85 N -2.09 2.28 -0.08 4.02 1.01 -1.26 -1.84 120.40 122.45 1xlj s VAL 85 Ca 0.39 -3.54 0.19 0.00 0.00 0.00 0.00 61.98 59.02 1xlj s VAL 85 Cb -0.09 -2.54 0.16 0.00 0.00 0.00 0.00 36.38 33.91 1xlj s VAL 85 CO 0.30 -0.95 1.61 1.55 0.00 0.00 0.00 175.10 177.61 1xlj h PRO 86 N 5.96 0.00 -3.35 2.72 0.14 -1.86 -2.85 132.00 132.76 1xlj h PRO 86 Ca 0.07 0.00 -0.14 0.00 0.14 0.00 0.00 66.00 66.06 1xlj h PRO 86 Cb 0.84 0.00 -0.22 0.00 0.14 0.00 0.00 31.00 31.76 1xlj h PRO 86 CO 0.63 0.33 -0.44 1.41 0.14 0.00 0.00 178.00 180.07 1xlj s MET 87 N -3.26 0.48 0.01 0.86 -2.45 -1.26 -1.94 119.30 111.74 1xlj s MET 87 Ca 0.03 -0.22 0.01 0.00 -1.25 0.00 0.00 55.69 54.27 1xlj s MET 87 Cb 0.08 0.20 -0.01 0.00 1.25 0.00 0.00 34.83 36.35 1xlj s MET 87 CO 0.69 -0.11 -0.05 0.08 1.05 0.00 0.00 175.02 176.68 1xlj s VAL 88 N -1.07 0.34 0.17 10.11 1.01 -0.97 -3.84 120.40 126.13 1xlj s VAL 88 Ca -0.12 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.31 1xlj s VAL 88 Cb -0.06 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 1xlj s VAL 88 CO 0.02 -0.16 0.04 0.28 0.00 0.00 0.00 175.10 175.28 1xlj s THR 89 N -0.71 0.39 0.10 3.92 -1.32 -0.55 -2.80 115.64 114.67 1xlj s THR 89 Ca -0.05 -1.95 0.04 0.00 -1.21 0.00 0.00 61.69 58.52 1xlj s THR 89 Cb -0.05 -2.16 -0.04 0.00 -1.51 0.00 0.00 72.50 68.73 1xlj s THR 89 CO -0.00 -0.39 0.05 -0.89 -2.21 0.00 0.00 174.62 171.17 1xlj s THR 90 N -3.86 4.25 -0.44 5.08 2.01 -1.26 -1.84 115.64 119.58 1xlj s THR 90 Ca 0.26 -0.94 -0.15 0.00 0.31 0.00 0.00 61.69 61.17 1xlj s THR 90 Cb 0.07 -3.06 0.05 0.00 0.01 0.00 0.00 72.50 69.56 1xlj s THR 90 CO 0.05 0.08 0.35 0.21 -0.69 0.00 0.00 174.62 174.61 1xlj s ASN 91 N -2.48 6.13 -0.31 3.53 3.84 -1.26 -4.85 114.94 119.55 1xlj s ASN 91 Ca 0.28 -1.11 0.07 0.00 0.21 0.00 0.00 52.86 52.32 1xlj s ASN 91 Cb -0.12 -2.17 0.46 0.00 -0.55 0.00 0.00 41.25 38.87 1xlj s ASN 91 CO 0.20 -0.55 1.34 0.18 -2.79 0.00 0.00 177.10 175.48 1xlj n LEU 92 N 5.18 4.47 0.00 3.21 4.77 -1.26 -4.67 117.00 128.70 1xlj n LEU 92 Ca -0.12 -4.29 0.00 0.00 -0.03 0.00 0.00 56.01 51.57 1xlj n LEU 92 Cb 0.45 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1xlj n LEU 92 CO 0.44 1.70 -0.02 2.22 -1.33 0.00 0.00 177.39 180.40 1xlj n PHE 93 N -0.92 0.00 0.09 -1.77 1.16 -1.26 -4.41 117.46 110.34 1xlj n PHE 93 Ca 0.37 0.00 -0.20 0.00 -1.87 0.00 0.00 57.45 55.75 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 -4.05 5.98 0.02 -1.94 -3.46 113.55 110.66 1xlj h SER 94 Ca 0.00 -0.72 -0.50 0.00 -0.84 0.00 0.00 61.79 59.73 1xlj h SER 94 Cb 0.01 -0.18 0.07 0.00 0.14 0.00 0.00 62.40 62.44 1xlj h SER 94 CO 0.00 1.59 0.45 -2.28 -1.14 0.00 0.00 176.83 175.45 1xlj s HIS 95 N -2.61 2.77 0.53 3.45 5.65 -1.26 -4.94 115.29 118.89 1xlj s HIS 95 Ca -0.10 1.54 0.25 0.00 0.25 0.00 0.00 55.06 57.00 1xlj s HIS 95 Cb 0.06 -3.31 1.39 0.00 -1.18 0.00 0.00 32.58 29.54 1xlj s HIS 95 CO 0.88 -1.49 2.00 -1.35 -0.65 0.00 0.00 174.74 174.12 1xlj h PRO 96 N 1.55 0.00 -1.00 2.88 0.11 -2.02 -0.82 132.00 132.69 1xlj h PRO 96 Ca -0.50 -0.00 0.18 0.00 0.11 0.00 0.00 66.00 65.79 1xlj h PRO 96 Cb 1.25 -0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.26 1xlj h PRO 96 CO 0.58 0.00 0.62 -0.24 -0.21 0.00 0.00 178.00 178.75 1xlj h VAL 97 N 0.00 0.74 -0.10 3.15 3.04 -1.97 -1.45 116.25 119.67 1xlj h VAL 97 Ca 0.25 -0.28 0.00 0.00 -1.01 0.00 0.00 66.70 65.66 1xlj h VAL 97 Cb 0.98 -0.13 0.00 0.00 -2.01 0.00 0.00 31.29 30.13 1xlj h VAL 97 CO -0.00 0.15 0.00 0.49 -1.01 0.00 0.00 177.57 177.19 1xlj n PHE 98 N -4.73 0.32 0.18 3.17 3.72 -0.31 -4.55 117.46 115.25 1xlj n PHE 98 Ca 0.23 -0.11 0.12 0.00 -0.05 0.00 0.00 57.45 57.64 1xlj n PHE 98 Cb 0.54 -0.14 0.67 0.00 -0.94 0.00 0.00 39.48 39.61 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 0.67 0.00 -0.30 -1.08 2.10 -1.41 -0.60 116.57 115.94 1xlj h LYS 99 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1xlj h LYS 99 Cb 0.66 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.99 1xlj h LYS 99 CO 0.07 0.00 0.00 -3.47 -2.00 0.00 0.00 179.45 174.05 1xlj n ASP 100 N -4.43 3.25 0.00 7.07 2.03 -1.26 -5.02 116.55 118.19 1xlj n ASP 100 Ca 0.01 -2.40 0.00 0.00 0.52 0.00 0.00 54.79 52.92 1xlj n ASP 100 Cb 0.26 -0.34 0.00 0.00 -0.72 0.00 0.00 41.12 40.32 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 0.07 1.60 0.00 0.27 0.00 -0.24 -3.68 105.19 103.22 1xlj n GLY 101 Ca 0.15 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 44.03 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 -0.08 -0.14 0.32 -0.02 0.00 -1.26 -4.35 105.19 99.67 1xlj n GLY 102 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 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 0.28 -0.08 1.61 0.04 -1.90 -3.08 116.94 113.82 1xlj h PHE 103 Ca 0.00 0.01 -0.05 0.00 2.80 0.00 0.00 57.97 60.73 1xlj h PHE 103 Cb 0.00 -0.09 -0.04 0.00 2.20 0.00 0.00 35.95 38.02 1xlj h PHE 103 CO 0.00 0.15 -0.48 0.25 -0.60 0.00 0.00 178.31 177.64 1xlj n THR 104 N -4.47 2.26 -1.73 -1.55 -2.24 -1.26 -4.38 114.28 100.91 1xlj n THR 104 Ca 0.05 -3.26 -0.36 0.00 -2.27 0.00 0.00 64.05 58.21 1xlj n THR 104 Cb 0.27 -0.30 0.07 0.00 -2.10 0.00 0.00 70.33 68.26 1xlj n THR 104 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1xlj s SER 105 N -3.19 4.66 0.26 3.42 0.15 -1.16 -4.83 113.70 113.01 1xlj s SER 105 Ca 0.39 2.46 0.13 0.00 0.70 0.00 0.00 55.95 59.64 1xlj s SER 105 Cb 0.38 -2.60 0.19 0.00 -1.71 0.00 0.00 66.02 62.28 1xlj s SER 105 CO -0.06 -1.96 1.50 0.78 1.20 0.00 0.00 173.24 174.70 1xlj h ASN 106 N 0.38 0.00 -3.47 5.45 2.35 -1.93 -3.43 115.58 114.93 1xlj h ASN 106 Ca -0.50 0.00 -0.59 0.00 -0.55 0.00 0.00 56.30 54.67 1xlj h ASN 106 Cb 1.31 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 39.60 1xlj h ASN 106 CO 0.53 0.62 0.68 -0.62 -1.65 0.00 0.00 177.43 176.99 1xlj s ASP 107 N -6.58 6.73 0.42 5.81 -1.08 -1.26 -4.98 116.67 115.74 1xlj s ASP 107 Ca 0.01 0.68 0.12 0.00 -0.52 0.00 0.00 52.55 52.84 1xlj s ASP 107 Cb 0.10 -2.49 0.92 0.00 -1.46 0.00 0.00 42.92 39.99 1xlj s ASP 107 CO 0.75 -0.89 1.98 -0.09 0.52 0.00 0.00 175.17 177.44 1xlj h ARG 108 N 8.45 0.16 -0.21 4.34 2.43 -1.99 -2.01 114.38 125.54 1xlj h ARG 108 Ca -0.23 -0.03 -0.17 0.00 -0.81 0.00 0.00 59.98 58.75 1xlj h ARG 108 Cb 1.07 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.60 1xlj h ARG 108 CO 1.00 0.27 -0.52 0.66 -1.51 0.00 0.00 179.97 179.87 1xlj h SER 109 N 0.15 0.82 -0.51 -3.80 4.64 -1.97 -1.73 113.55 111.16 1xlj h SER 109 Ca 0.03 -0.57 0.03 0.00 -0.47 0.00 0.00 61.79 60.81 1xlj h SER 109 Cb 0.28 -0.24 -0.04 0.00 -0.31 0.00 0.00 62.40 62.09 1xlj h SER 109 CO 0.02 1.24 0.29 0.40 -0.87 0.00 0.00 176.83 177.91 1xlj h ILE 110 N 0.44 1.03 -0.94 0.95 2.04 -1.91 -0.76 117.51 118.36 1xlj h ILE 110 Ca -0.01 -0.20 0.03 0.00 1.00 0.00 0.00 64.86 65.69 1xlj h ILE 110 Cb 1.14 0.40 -0.05 0.00 -0.74 0.00 0.00 36.82 37.56 1xlj h ILE 110 CO 0.11 0.11 0.62 0.03 0.00 0.00 0.00 178.15 179.01 1xlj h ARG 111 N 0.58 1.17 -0.23 2.37 3.08 -1.09 0.17 114.38 120.43 1xlj h ARG 111 Ca 0.21 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 1xlj h ARG 111 Cb 0.05 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.83 1xlj h ARG 111 CO -0.11 0.77 0.06 0.00 -1.07 0.00 0.00 179.97 179.62 1xlj h ARG 112 N 1.21 0.36 -0.08 0.04 3.08 -0.80 -1.28 114.38 116.92 1xlj h ARG 112 Ca 0.37 -0.09 0.01 0.00 0.07 0.00 0.00 59.98 60.34 1xlj h ARG 112 Cb -0.02 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 1xlj h ARG 112 CO -0.11 0.47 0.02 0.35 -1.07 0.00 0.00 179.97 179.63 1xlj h PHE 113 N 0.19 0.03 -0.30 3.04 3.57 -0.37 -1.45 116.94 121.65 1xlj h PHE 113 Ca 0.07 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.61 1xlj h PHE 113 Cb 0.27 -0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.98 1xlj h PHE 113 CO 0.01 0.01 0.07 0.00 -2.23 0.00 0.00 178.31 176.18 1xlj h ALA 114 N 1.06 0.32 -0.73 2.41 0.00 -0.65 0.17 119.26 121.84 1xlj h ALA 114 Ca 0.04 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1xlj h ALA 114 Cb 0.03 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1xlj h ALA 114 CO -0.05 -0.33 0.24 1.25 0.00 0.00 0.00 179.25 180.36 1xlj h LEU 115 N 0.19 1.04 -0.29 0.00 5.85 -0.97 -2.50 115.31 118.63 1xlj h LEU 115 Ca 0.14 -0.19 0.04 0.00 0.84 0.00 0.00 57.88 58.71 1xlj h LEU 115 Cb 0.13 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 1xlj h LEU 115 CO -0.17 0.96 0.07 0.00 -0.34 0.00 0.00 178.44 178.96 1xlj h ALA 116 N 1.18 0.31 -0.92 1.25 0.00 -0.43 -0.34 119.26 120.32 1xlj h ALA 116 Ca 0.24 0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.26 1xlj h ALA 116 Cb 0.28 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.05 1xlj h ALA 116 CO -0.01 -0.34 0.58 -0.22 0.00 0.00 0.00 179.25 179.26 1xlj h LYS 117 N 0.18 1.02 0.48 0.00 3.64 -0.87 -0.99 116.57 120.04 1xlj h LYS 117 Ca 0.13 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 1xlj h LYS 117 Cb 0.12 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 1xlj h LYS 117 CO -0.16 0.67 -0.23 0.28 -2.27 0.00 0.00 179.45 177.74 1xlj h VAL 118 N 1.05 0.42 -0.30 2.00 2.07 -0.91 -2.75 116.25 117.83 1xlj h VAL 118 Ca 0.40 -0.41 0.06 0.00 0.82 0.00 0.00 66.70 67.57 1xlj h VAL 118 Cb 0.18 0.57 -0.06 0.00 -1.52 0.00 0.00 31.29 30.46 1xlj h VAL 118 CO -0.18 0.06 -0.13 -0.07 0.02 0.00 0.00 177.57 177.28 1xlj h LEU 119 N -0.93 -0.43 -0.55 2.57 3.38 -0.61 -1.22 115.31 117.52 1xlj h LEU 119 Ca -0.07 0.11 0.10 0.00 0.09 0.00 0.00 57.88 58.11 1xlj h LEU 119 Cb 0.59 0.25 -0.08 0.00 0.09 0.00 0.00 40.66 41.51 1xlj h LEU 119 CO 0.11 -0.16 0.12 0.45 0.09 0.00 0.00 178.44 179.05 1xlj h HIS 120 N -0.08 0.20 0.00 1.13 3.86 -1.28 -2.02 115.15 116.96 1xlj h HIS 120 Ca 0.15 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.38 1xlj h HIS 120 Cb 0.31 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 28.77 1xlj h HIS 120 CO -0.33 -0.00 -0.05 -0.97 0.86 0.00 0.00 177.93 177.44 1xlj h ASN 121 N 0.26 0.00 -0.41 2.45 -1.24 -0.93 -2.84 115.58 112.87 1xlj h ASN 121 Ca 0.28 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.28 1xlj h ASN 121 Cb 0.39 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.42 1xlj h ASN 121 CO -0.35 0.05 0.22 0.40 -1.29 0.00 0.00 177.43 176.46 1xlj h ILE 122 N 0.00 1.16 0.24 2.57 2.04 -0.69 0.16 117.51 122.99 1xlj h ILE 122 Ca -0.00 -0.41 0.01 0.00 1.00 0.00 0.00 64.86 65.45 1xlj h ILE 122 Cb 0.09 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 36.82 1xlj h ILE 122 CO 0.01 0.16 -0.37 0.44 0.00 0.00 0.00 178.15 178.39 1xlj h ASP 123 N 0.53 -1.04 -0.18 1.72 3.32 -1.45 0.54 116.42 119.85 1xlj h ASP 123 Ca 0.14 0.11 0.03 0.00 0.02 0.00 0.00 57.03 57.33 1xlj h ASP 123 Cb 0.07 0.38 -0.03 0.00 0.22 0.00 0.00 39.33 39.96 1xlj h ASP 123 CO -0.02 -0.48 -0.03 0.25 -1.72 0.00 0.00 179.24 177.24 1xlj h LEU 124 N -0.68 -0.14 -0.44 1.55 5.85 -1.36 0.30 115.31 120.40 1xlj h LEU 124 Ca 0.00 0.05 0.09 0.00 0.84 0.00 0.00 57.88 58.86 1xlj h LEU 124 Cb 0.66 0.10 -0.09 0.00 0.37 0.00 0.00 40.66 41.70 1xlj h LEU 124 CO -0.15 -0.04 -0.12 0.00 -0.34 0.00 0.00 178.44 177.79 1xlj h ALA 125 N 1.17 0.28 -0.21 1.25 0.00 -0.35 0.51 119.26 121.91 1xlj h ALA 125 Ca 0.09 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1xlj h ALA 125 Cb 0.12 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1xlj h ALA 125 CO -0.17 -0.46 0.12 0.00 0.00 0.00 0.00 179.25 178.74 1xlj h ALA 126 N 1.42 0.27 -0.32 0.00 0.00 0.91 -2.88 119.26 118.67 1xlj h ALA 126 Ca 0.21 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.13 1xlj h ALA 126 Cb 0.34 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.99 1xlj h ALA 126 CO -0.47 -0.20 -0.07 0.93 0.00 0.00 0.00 179.25 179.44 1xlj h GLU 127 N 0.25 0.01 0.00 0.00 5.08 0.12 -2.58 114.58 117.46 1xlj h GLU 127 Ca 0.08 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1xlj h GLU 127 Cb 0.05 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1xlj h GLU 127 CO -0.01 0.01 0.00 -1.33 -1.00 0.00 0.00 179.01 176.68 1xlj n MET 128 N -5.25 0.01 -0.81 2.33 2.81 0.01 -4.89 117.12 111.34 1xlj n MET 128 Ca 0.00 0.42 0.00 0.00 -1.81 0.00 0.00 57.70 56.32 1xlj n MET 128 Cb 0.18 -1.52 0.00 0.00 -0.71 0.00 0.00 33.22 31.17 1xlj n MET 128 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xlj n GLY 129 N -0.99 0.54 3.76 3.03 0.00 -0.97 -4.54 105.19 106.01 1xlj n GLY 129 Ca 0.01 -0.56 -0.41 0.00 0.00 0.00 0.00 46.02 45.07 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 3.44 -0.03 4.61 0.00 -1.08 -4.76 121.76 121.94 1xlj s ALA 130 Ca 0.00 1.01 -0.13 0.00 0.00 0.00 0.00 51.96 52.84 1xlj s ALA 130 Cb 0.00 -3.39 -0.32 0.00 0.00 0.00 0.00 23.12 19.41 1xlj s ALA 130 CO 0.00 -0.33 0.74 0.93 0.00 0.00 0.00 175.76 177.10 1xlj h GLU 131 N 3.99 0.43 -6.31 0.00 5.08 -1.60 -3.44 114.58 112.74 1xlj h GLU 131 Ca -0.47 -0.73 -0.68 0.00 -1.00 0.00 0.00 59.36 56.47 1xlj h GLU 131 Cb 1.22 0.27 -0.20 0.00 0.50 0.00 0.00 28.75 30.54 1xlj h GLU 131 CO 0.68 1.35 -0.74 0.99 -1.00 0.00 0.00 179.01 180.30 1xlj s THR 132 N -2.58 3.35 -0.32 1.13 2.01 -0.87 -1.71 115.64 116.66 1xlj s THR 132 Ca -0.14 -0.75 0.01 0.00 0.31 0.00 0.00 61.69 61.12 1xlj s THR 132 Cb 0.05 -2.39 0.08 0.00 0.01 0.00 0.00 72.50 70.25 1xlj s THR 132 CO 0.87 0.50 0.01 0.12 -0.69 0.00 0.00 174.62 175.43 1xlj s PHE 133 N -0.86 3.47 -0.02 4.92 5.36 -0.22 -2.30 117.98 128.33 1xlj s PHE 133 Ca 0.14 -2.46 -0.14 0.00 -0.96 0.00 0.00 56.93 53.51 1xlj s PHE 133 Cb -0.11 -2.47 -0.05 0.00 -0.34 0.00 0.00 43.02 40.04 1xlj s PHE 133 CO 0.04 -0.90 0.38 0.08 -1.46 0.00 0.00 175.22 173.35 1xlj s VAL 134 N 1.08 5.09 -0.24 3.12 1.01 -1.12 0.40 120.40 129.74 1xlj s VAL 134 Ca 0.01 0.77 0.02 0.00 0.00 0.00 0.00 61.98 62.77 1xlj s VAL 134 Cb -0.20 -3.68 0.06 0.00 0.00 0.00 0.00 36.38 32.56 1xlj s VAL 134 CO -0.05 0.57 -0.09 -0.04 0.00 0.00 0.00 175.10 175.49 1xlj s MET 135 N -0.96 1.99 -0.39 2.72 1.00 -0.09 -4.20 119.30 119.36 1xlj s MET 135 Ca 0.23 -1.14 -0.04 0.00 0.00 0.00 0.00 55.69 54.74 1xlj s MET 135 Cb -0.16 -2.71 0.09 0.00 0.00 0.00 0.00 34.83 32.05 1xlj s MET 135 CO 0.12 -0.56 0.18 -0.46 0.00 0.00 0.00 175.02 174.30 1xlj s TRP 136 N 1.25 3.49 -1.26 -0.03 -0.00 -1.26 -1.15 118.94 119.97 1xlj s TRP 136 Ca -0.07 -2.16 -0.11 0.00 -0.00 0.00 0.00 56.10 53.76 1xlj s TRP 136 Cb -0.19 -2.99 0.16 0.00 -0.00 0.00 0.00 33.47 30.45 1xlj s TRP 136 CO -0.06 -0.92 1.73 0.41 -0.00 0.00 0.00 176.95 178.10 1xlj n GLY 137 N 4.66 4.18 0.24 5.86 0.00 -1.26 -4.81 105.19 114.06 1xlj n GLY 137 Ca -0.06 -2.03 0.05 0.00 0.00 0.00 0.00 46.02 43.98 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 8.77 0.11 -1.93 -0.02 0.00 -1.91 -2.75 103.07 105.35 1xlj h GLY 138 Ca 0.38 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.64 1xlj h GLY 138 CO 1.49 0.06 0.00 0.54 0.00 0.00 0.00 176.54 178.63 1xlj n ARG 139 N -4.34 2.19 -2.62 4.80 5.12 -1.26 -3.90 116.66 116.64 1xlj n ARG 139 Ca -0.02 -1.99 -0.42 0.00 -1.93 0.00 0.00 57.85 53.49 1xlj n ARG 139 Cb 0.22 -1.44 -0.03 0.00 -1.16 0.00 0.00 32.46 30.05 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 -1.57 3.51 0.00 5.56 0.41 -1.04 -2.61 118.70 122.96 1xlj s GLU 140 Ca 0.30 0.20 0.00 0.00 -0.41 0.00 0.00 54.97 55.07 1xlj s GLU 140 Cb 0.19 -4.01 0.00 0.00 -1.78 0.00 0.00 34.13 28.53 1xlj s GLU 140 CO 0.28 -1.62 0.00 0.41 -0.49 0.00 0.00 175.26 173.83 1xlj n GLY 141 N 5.05 -0.31 3.76 -1.39 0.00 -1.26 -1.02 105.19 110.02 1xlj n GLY 141 Ca 0.08 -0.90 -0.04 0.00 0.00 0.00 0.00 46.02 45.15 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 -0.19 -0.19 1.61 1.04 -0.86 -4.97 113.70 106.14 1xlj s SER 142 Ca 0.00 -0.41 0.13 0.00 0.48 0.00 0.00 55.95 56.14 1xlj s SER 142 Cb 0.00 0.51 -0.20 0.00 0.10 0.00 0.00 66.02 66.43 1xlj s SER 142 CO 0.00 -0.94 -0.00 -0.62 0.98 0.00 0.00 173.24 172.66 1xlj n GLU 143 N -0.46 0.96 -5.14 4.02 4.71 -1.26 -1.17 120.64 122.29 1xlj n GLU 143 Ca -0.06 0.02 -0.31 0.00 -0.01 0.00 0.00 57.16 56.81 1xlj n GLU 143 Cb 0.61 -1.46 -0.15 0.00 -1.01 0.00 0.00 31.44 29.42 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 -2.44 2.36 0.36 -0.32 2.02 -1.26 -4.90 117.35 113.16 1xlj s TYR 144 Ca -0.14 -0.41 0.12 0.00 -0.37 0.00 0.00 57.07 56.27 1xlj s TYR 144 Cb 0.06 -1.47 0.68 0.00 -0.40 0.00 0.00 41.96 40.83 1xlj s TYR 144 CO 0.68 0.03 1.81 -0.44 -1.57 0.00 0.00 175.55 176.07 1xlj h ASP 145 N 5.24 0.02 -0.19 2.29 3.32 -1.98 -3.14 116.42 121.98 1xlj h ASP 145 Ca -0.44 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1xlj h ASP 145 Cb 1.13 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.67 1xlj h ASP 145 CO 0.46 0.40 0.00 0.61 -1.72 0.00 0.00 179.24 179.00 1xlj n GLY 146 N -0.42 0.39 0.26 2.75 0.00 -1.26 -4.29 105.19 102.61 1xlj n GLY 146 Ca -0.02 -0.43 0.11 0.00 0.00 0.00 0.00 46.02 45.68 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 2.30 0.00 -4.46 1.61 0.02 -1.99 -3.45 113.55 107.58 1xlj h SER 147 Ca 0.00 0.00 -0.37 0.00 -0.84 0.00 0.00 61.79 60.58 1xlj h SER 147 Cb 0.51 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 62.82 1xlj h SER 147 CO 0.00 0.12 -0.77 -0.54 -1.14 0.00 0.00 176.83 174.50 1xlj s LYS 148 N -4.35 0.73 -0.40 3.45 -0.14 -1.26 -5.05 119.74 112.72 1xlj s LYS 148 Ca -0.03 -0.76 -0.18 0.00 -1.36 0.00 0.00 55.97 53.63 1xlj s LYS 148 Cb 0.14 -0.67 0.01 0.00 -1.68 0.00 0.00 37.83 35.63 1xlj s LYS 148 CO 0.61 0.15 0.52 0.34 -0.76 0.00 0.00 175.35 176.21 1xlj s ASP 149 N -1.34 6.27 0.26 2.83 -1.08 -1.26 -4.96 116.67 117.38 1xlj s ASP 149 Ca -0.03 -0.37 0.02 0.00 -0.52 0.00 0.00 52.55 51.66 1xlj s ASP 149 Cb -0.09 -2.26 0.33 0.00 -1.46 0.00 0.00 42.92 39.44 1xlj s ASP 149 CO 0.01 -0.60 1.65 0.25 0.52 0.00 0.00 175.17 177.00 1xlj h LEU 150 N 9.25 0.44 -0.14 -1.34 7.12 -1.98 0.34 115.31 128.99 1xlj h LEU 150 Ca -0.27 -0.19 -0.06 0.00 0.13 0.00 0.00 57.88 57.50 1xlj h LEU 150 Cb 1.11 -0.12 -0.00 0.00 -0.53 0.00 0.00 40.66 41.12 1xlj h LEU 150 CO 0.81 0.79 -0.14 0.00 -0.13 0.00 0.00 178.44 179.78 1xlj h ALA 151 N 1.23 0.21 -0.31 1.25 0.00 -2.01 -2.99 119.26 116.64 1xlj h ALA 151 Ca 0.03 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 1xlj h ALA 151 Cb 0.84 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 1xlj h ALA 151 CO 0.07 0.08 -0.09 0.00 0.00 0.00 0.00 179.25 179.31 1xlj h ALA 152 N 0.61 1.27 -0.97 0.00 0.00 -1.96 -2.40 119.26 115.80 1xlj h ALA 152 Ca 0.02 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.68 1xlj h ALA 152 Cb 0.66 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 1xlj h ALA 152 CO 0.03 0.48 0.63 0.00 0.00 0.00 0.00 179.25 180.39 1xlj h ALA 153 N 1.43 1.23 -0.17 0.00 0.00 -0.19 -1.32 119.26 120.24 1xlj h ALA 153 Ca 0.09 -0.08 -0.17 0.00 0.00 0.00 0.00 54.91 54.76 1xlj h ALA 153 Cb 0.45 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1xlj h ALA 153 CO 0.02 0.64 -0.58 -0.07 0.00 0.00 0.00 179.25 179.27 1xlj h LEU 154 N 1.32 0.62 -0.44 0.00 3.38 -1.36 -2.58 115.31 116.26 1xlj h LEU 154 Ca 0.35 -0.34 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1xlj h LEU 154 Cb -0.13 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 1xlj h LEU 154 CO -0.07 1.06 0.13 0.44 0.09 0.00 0.00 178.44 180.09 1xlj h ASP 155 N 0.42 0.64 -0.54 -0.43 3.32 -1.20 0.35 116.42 118.98 1xlj h ASP 155 Ca 0.00 -0.21 0.02 0.00 0.02 0.00 0.00 57.03 56.87 1xlj h ASP 155 Cb 1.13 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 40.48 1xlj h ASP 155 CO 0.11 0.68 0.33 0.03 -1.72 0.00 0.00 179.24 178.67 1xlj h ARG 156 N 0.57 0.63 -0.13 3.56 2.47 -1.21 0.22 114.38 120.49 1xlj h ARG 156 Ca 0.14 -0.04 -0.00 0.00 -1.26 0.00 0.00 59.98 58.82 1xlj h ARG 156 Cb 0.27 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 28.44 1xlj h ARG 156 CO -0.00 0.42 0.08 1.98 0.56 0.00 0.00 179.97 183.00 1xlj h MET 157 N 0.65 0.17 -0.40 0.04 4.05 -1.30 -2.13 114.93 116.01 1xlj h MET 157 Ca 0.22 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.61 1xlj h MET 157 Cb 0.02 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 30.76 1xlj h MET 157 CO -0.09 0.16 0.22 -0.09 0.23 0.00 0.00 176.91 177.34 1xlj h ARG 158 N 0.13 0.56 0.00 0.39 2.43 -0.48 -1.78 114.38 115.64 1xlj h ARG 158 Ca 0.05 -0.07 0.03 0.00 -0.81 0.00 0.00 59.98 59.18 1xlj h ARG 158 Cb 0.04 -0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 29.42 1xlj h ARG 158 CO -0.01 0.46 -0.43 1.49 -1.51 0.00 0.00 179.97 179.97 1xlj h GLU 159 N 0.52 -0.57 0.24 0.20 4.81 -0.32 -0.31 114.58 119.15 1xlj h GLU 159 Ca 0.14 0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.42 1xlj h GLU 159 Cb 0.06 0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.54 1xlj h GLU 159 CO -0.02 -0.38 -0.34 0.78 -0.73 0.00 0.00 179.01 178.32 1xlj h GLY 160 N -0.59 -0.74 0.94 1.92 0.00 -1.31 -0.45 103.07 102.85 1xlj h GLY 160 Ca 0.04 0.40 -0.02 0.00 0.00 0.00 0.00 47.33 47.75 1xlj h GLY 160 CO -0.32 -0.27 0.16 -2.08 0.00 0.00 0.00 176.54 174.02 1xlj h VAL 161 N -0.65 1.19 -0.13 4.60 2.07 -1.22 -2.62 116.25 119.50 1xlj h VAL 161 Ca 0.00 -0.60 -0.10 0.00 0.82 0.00 0.00 66.70 66.82 1xlj h VAL 161 Cb 0.63 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1xlj h VAL 161 CO -0.13 0.22 -0.38 0.44 0.02 0.00 0.00 177.57 177.74 1xlj h ASP 162 N 0.49 0.29 -0.31 0.57 3.32 -1.00 -2.73 116.42 117.05 1xlj h ASP 162 Ca 0.13 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1xlj h ASP 162 Cb 0.19 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 1xlj h ASP 162 CO -0.01 0.64 0.16 0.74 -1.72 0.00 0.00 179.24 179.05 1xlj h THR 163 N 0.24 1.15 -0.70 0.35 2.02 -0.85 -0.03 112.91 115.09 1xlj h THR 163 Ca 0.03 -0.42 -0.04 0.00 0.77 0.00 0.00 66.41 66.75 1xlj h THR 163 Cb 0.77 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 1xlj h THR 163 CO 0.06 0.15 0.29 0.00 0.37 0.00 0.00 175.52 176.39 1xlj h ALA 164 N 1.02 1.19 -0.00 6.16 0.00 -1.44 -0.45 119.26 125.74 1xlj h ALA 164 Ca 0.11 -0.17 -0.25 0.00 0.00 0.00 0.00 54.91 54.60 1xlj h ALA 164 Cb 0.10 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.63 1xlj h ALA 164 CO -0.01 0.59 -1.00 0.00 0.00 0.00 0.00 179.25 178.82 1xlj h ALA 165 N 1.31 0.22 -0.26 0.00 0.00 -1.39 -2.43 119.26 116.70 1xlj h ALA 165 Ca 0.24 -0.70 -0.06 0.00 0.00 0.00 0.00 54.91 54.39 1xlj h ALA 165 Cb 0.18 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1xlj h ALA 165 CO -0.02 0.73 -0.06 0.78 0.00 0.00 0.00 179.25 180.68 1xlj h GLY 166 N 0.70 0.54 0.70 0.00 0.00 -0.78 -2.37 103.07 101.88 1xlj h GLY 166 Ca -0.11 -0.45 0.03 0.00 0.00 0.00 0.00 47.33 46.80 1xlj h GLY 166 CO 0.19 0.41 -0.07 -1.82 0.00 0.00 0.00 176.54 175.25 1xlj h TYR 167 N 0.25 -0.17 -0.49 5.60 3.20 -1.11 0.39 116.97 124.64 1xlj h TYR 167 Ca 0.07 0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.04 1xlj h TYR 167 Cb 0.53 0.09 -0.08 0.00 1.54 0.00 0.00 36.73 38.81 1xlj h TYR 167 CO 0.05 -0.11 0.02 0.82 -1.64 0.00 0.00 178.16 177.30 1xlj h ILE 168 N -0.08 0.64 -0.07 1.81 2.04 -1.33 -0.25 117.51 120.27 1xlj h ILE 168 Ca 0.06 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.88 1xlj h ILE 168 Cb 0.17 0.49 -0.00 0.00 -0.74 0.00 0.00 36.82 36.74 1xlj h ILE 168 CO -0.14 0.02 0.05 0.11 0.00 0.00 0.00 178.15 178.19 1xlj h LYS 169 N 0.13 0.10 -0.74 2.37 1.57 -1.07 -2.29 116.57 116.64 1xlj h LYS 169 Ca 0.24 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.98 1xlj h LYS 169 Cb 0.36 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.62 1xlj h LYS 169 CO -0.39 0.07 0.33 -0.44 -0.57 0.00 0.00 179.45 178.44 1xlj h ASP 170 N 0.10 1.00 0.86 0.86 3.32 -0.43 -2.99 116.42 119.14 1xlj h ASP 170 Ca 0.03 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.92 1xlj h ASP 170 Cb -0.01 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.28 1xlj h ASP 170 CO -0.01 0.88 0.00 0.29 -1.72 0.00 0.00 179.24 178.68 1xlj n LYS 171 N -4.36 0.05 -1.17 3.56 4.76 -0.15 -4.95 118.16 115.89 1xlj n LYS 171 Ca 0.06 0.04 -0.06 0.00 -2.87 0.00 0.00 58.31 55.49 1xlj n LYS 171 Cb 0.16 -1.50 -0.03 0.00 -1.84 0.00 0.00 35.03 31.82 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 1.20 0.82 3.76 0.72 0.00 -0.87 -5.03 105.19 105.78 1xlj n GLY 172 Ca 0.07 -0.48 -0.40 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.11 3.39 -0.89 1.61 2.02 -1.13 -4.98 117.35 115.27 1xlj s TYR 173 Ca 0.00 1.62 -0.14 0.00 -0.37 0.00 0.00 57.07 58.18 1xlj s TYR 173 Cb 0.00 -3.37 0.21 0.00 -0.40 0.00 0.00 41.96 38.39 1xlj s TYR 173 CO 0.00 -0.92 0.89 -0.80 -1.57 0.00 0.00 175.55 173.15 1xlj s ASN 174 N -0.86 6.81 -0.04 2.29 -0.87 -1.26 -4.81 114.94 116.20 1xlj s ASN 174 Ca 0.47 -2.67 -0.03 0.00 -1.57 0.00 0.00 52.86 49.07 1xlj s ASN 174 Cb -0.33 -2.25 0.02 0.00 -0.02 0.00 0.00 41.25 38.66 1xlj s ASN 174 CO 0.43 -0.64 0.09 -0.76 -2.57 0.00 0.00 177.10 173.65 1xlj s LEU 175 N 0.53 1.46 0.04 0.60 1.43 -1.25 -4.41 118.68 117.07 1xlj s LEU 175 Ca 0.23 0.19 0.07 0.00 -1.03 0.00 0.00 54.13 53.59 1xlj s LEU 175 Cb -0.09 0.28 -0.02 0.00 0.03 0.00 0.00 46.19 46.39 1xlj s LEU 175 CO -0.09 -0.06 -0.21 -0.13 0.23 0.00 0.00 176.35 176.10 1xlj s ARG 176 N 0.32 1.41 -0.10 1.70 0.52 -0.69 -4.99 118.95 117.12 1xlj s ARG 176 Ca -0.02 -0.94 -0.16 0.00 -0.52 0.00 0.00 55.73 54.10 1xlj s ARG 176 Cb -0.03 -1.52 -0.05 0.00 0.52 0.00 0.00 34.95 33.87 1xlj s ARG 176 CO -0.01 0.39 0.39 0.42 0.02 0.00 0.00 175.30 176.51 1xlj s ILE 177 N -0.79 5.19 -0.19 1.52 1.01 -0.70 -1.06 121.20 126.18 1xlj s ILE 177 Ca 0.07 0.77 0.01 0.00 0.00 0.00 0.00 60.65 61.51 1xlj s ILE 177 Cb -0.09 -3.72 0.03 0.00 0.01 0.00 0.00 42.46 38.69 1xlj s ILE 177 CO 0.02 0.43 -0.17 0.00 0.00 0.00 0.00 174.94 175.21 1xlj s ALA 178 N 0.05 2.30 0.12 9.38 0.00 0.16 -0.28 121.76 133.50 1xlj s ALA 178 Ca 0.22 -1.28 -0.19 0.00 0.00 0.00 0.00 51.96 50.71 1xlj s ALA 178 Cb -0.15 -1.25 -0.07 0.00 0.00 0.00 0.00 23.12 21.65 1xlj s ALA 178 CO 0.09 -0.54 0.61 -0.51 0.00 0.00 0.00 175.76 175.41 1xlj s LEU 179 N 1.29 4.46 -0.23 0.00 1.43 0.42 -0.92 118.68 125.13 1xlj s LEU 179 Ca 0.02 1.28 0.01 0.00 -1.03 0.00 0.00 54.13 54.41 1xlj s LEU 179 Cb -0.14 -3.14 0.06 0.00 0.03 0.00 0.00 46.19 43.00 1xlj s LEU 179 CO -0.11 0.19 -0.07 -0.70 0.23 0.00 0.00 176.35 175.88 1xlj s GLU 180 N -1.46 1.81 0.53 1.70 2.12 -0.30 -0.06 118.70 123.05 1xlj s GLU 180 Ca 0.34 -1.00 -0.17 0.00 0.36 0.00 0.00 54.97 54.51 1xlj s GLU 180 Cb -0.18 -2.58 -0.07 0.00 0.26 0.00 0.00 34.13 31.56 1xlj s GLU 180 CO 0.20 -0.55 1.01 -1.25 -0.54 0.00 0.00 175.26 174.13 1xlj s PRO 181 N 1.36 3.78 -0.28 4.30 0.05 -1.26 -4.29 135.00 138.66 1xlj s PRO 181 Ca -0.05 1.05 -0.18 0.00 0.05 0.00 0.00 61.00 61.87 1xlj s PRO 181 Cb -0.18 -2.11 0.12 0.00 0.05 0.00 0.00 34.50 32.38 1xlj s PRO 181 CO -0.07 -0.42 0.90 0.21 0.05 0.00 0.00 177.00 177.68 1xlj s LYS 182 N -3.99 0.50 0.17 4.56 2.20 -1.21 -4.67 119.74 117.29 1xlj s LYS 182 Ca 0.61 0.81 0.01 0.00 -0.36 0.00 0.00 55.97 57.04 1xlj s LYS 182 Cb -0.12 0.13 0.00 0.00 -1.51 0.00 0.00 37.83 36.34 1xlj s LYS 182 CO 0.31 -0.10 1.38 -1.00 -0.36 0.00 0.00 175.35 175.59 1xlj h PRO 183 N 5.98 0.24 -2.36 4.03 0.14 -1.76 -3.36 132.00 134.91 1xlj h PRO 183 Ca -0.29 -0.25 0.17 0.00 0.14 0.00 0.00 66.00 65.77 1xlj h PRO 183 Cb 1.20 0.07 -0.09 0.00 0.14 0.00 0.00 31.00 32.32 1xlj h PRO 183 CO 0.17 0.96 0.48 0.54 0.14 0.00 0.00 178.00 180.28 1xlj s ASN 184 N -6.95 -0.20 -0.01 1.44 4.22 -1.26 -0.96 114.94 111.21 1xlj s ASN 184 Ca -0.03 -0.36 -0.01 0.00 -2.14 0.00 0.00 52.86 50.31 1xlj s ASN 184 Cb 0.10 0.48 0.00 0.00 1.28 0.00 0.00 41.25 43.12 1xlj s ASN 184 CO 0.83 -0.88 0.02 1.21 -2.04 0.00 0.00 177.10 176.24 1xlj n GLU 185 N -0.44 -1.52 0.22 3.55 0.00 -1.26 -4.83 120.64 116.36 1xlj n GLU 185 Ca -0.06 1.46 0.12 0.00 0.00 0.00 0.00 57.16 58.67 1xlj n GLU 185 Cb 0.61 -1.91 0.19 0.00 0.00 0.00 0.00 31.44 30.33 1xlj n GLU 185 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.13 176.13 1xlj h PRO 186 N 1.27 0.00 -7.34 5.31 0.13 -2.00 -3.50 132.00 125.87 1xlj h PRO 186 Ca -0.05 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.58 1xlj h PRO 186 Cb 0.12 0.00 0.06 0.00 0.13 0.00 0.00 31.00 31.31 1xlj h PRO 186 CO 0.00 0.03 0.37 1.03 -0.23 0.00 0.00 178.00 179.20 1xlj s ARG 187 N -3.22 3.30 0.26 0.86 1.81 -1.25 -4.96 118.95 115.75 1xlj s ARG 187 Ca 0.07 0.55 -0.00 0.00 -1.72 0.00 0.00 55.73 54.62 1xlj s ARG 187 Cb 0.05 -2.10 0.34 0.00 -0.45 0.00 0.00 34.95 32.80 1xlj s ARG 187 CO 0.67 -0.70 1.71 0.78 -0.68 0.00 0.00 175.30 177.07 1xlj h GLY 188 N -0.37 0.66 -6.46 -3.53 0.00 -1.88 -3.42 103.07 88.07 1xlj h GLY 188 Ca -0.45 -0.52 -0.41 0.00 0.00 0.00 0.00 47.33 45.95 1xlj h GLY 188 CO 0.62 0.48 -0.77 0.99 0.00 0.00 0.00 176.54 177.87 1xlj s ASP 189 N -6.77 1.07 -0.01 0.19 1.01 -0.32 -4.66 116.67 107.19 1xlj s ASP 189 Ca -0.08 -0.11 -0.00 0.00 0.71 0.00 0.00 52.55 53.07 1xlj s ASP 189 Cb 0.14 -0.43 -0.04 0.00 1.01 0.00 0.00 42.92 43.61 1xlj s ASP 189 CO 0.80 -0.10 0.05 -0.63 0.21 0.00 0.00 175.17 175.50 1xlj s ILE 190 N 1.21 4.50 0.42 0.77 1.01 -0.13 -2.02 121.20 126.97 1xlj s ILE 190 Ca -0.07 -0.45 -0.26 0.00 0.00 0.00 0.00 60.65 59.88 1xlj s ILE 190 Cb -0.14 -3.03 -0.08 0.00 0.01 0.00 0.00 42.46 39.22 1xlj s ILE 190 CO -0.02 0.39 1.33 -0.36 0.00 0.00 0.00 174.94 176.29 1xlj s PHE 191 N -1.13 2.70 -0.91 3.97 0.08 -0.19 -3.38 117.98 119.13 1xlj s PHE 191 Ca 0.21 1.37 -0.05 0.00 0.12 0.00 0.00 56.93 58.57 1xlj s PHE 191 Cb -0.12 -3.73 -0.02 0.00 -0.57 0.00 0.00 43.02 38.58 1xlj s PHE 191 CO 0.11 -2.33 0.77 1.28 -0.10 0.00 0.00 175.22 174.95 1xlj n LEU 192 N -0.02 -5.25 0.27 -0.37 4.77 -1.26 -4.81 117.00 110.33 1xlj n LEU 192 Ca 0.04 -0.51 0.17 0.00 -0.03 0.00 0.00 56.01 55.68 1xlj n LEU 192 Cb 0.43 -2.94 0.66 0.00 -2.33 0.00 0.00 43.42 39.24 1xlj n LEU 192 CO 0.56 -0.34 0.98 1.55 -1.33 0.00 0.00 177.39 178.82 1xlj h PRO 193 N -0.46 0.00 -4.72 3.23 0.13 -1.71 -3.33 132.00 125.13 1xlj h PRO 193 Ca -0.36 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.49 1xlj h PRO 193 Cb 1.19 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.18 1xlj h PRO 193 CO 0.38 0.00 -0.62 0.95 -0.23 0.00 0.00 178.00 178.48 1xlj s THR 194 N -3.64 0.27 0.22 1.56 -4.23 -1.26 -2.57 115.64 105.99 1xlj s THR 194 Ca 0.02 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.42 1xlj s THR 194 Cb 0.09 -2.54 0.25 0.00 1.34 0.00 0.00 72.50 71.64 1xlj s THR 194 CO 0.55 -0.02 1.63 0.58 -0.54 0.00 0.00 174.62 176.82 1xlj h VAL 195 N 2.52 0.36 -0.08 2.29 2.07 -1.93 -0.85 116.25 120.63 1xlj h VAL 195 Ca -0.37 -0.02 0.04 0.00 0.82 0.00 0.00 66.70 67.17 1xlj h VAL 195 Cb 1.25 0.31 -0.06 0.00 -1.52 0.00 0.00 31.29 31.27 1xlj h VAL 195 CO 0.57 0.01 -0.38 1.23 0.02 0.00 0.00 177.57 179.02 1xlj h GLY 196 N 0.05 -0.63 1.27 2.17 0.00 -1.96 0.14 103.07 104.11 1xlj h GLY 196 Ca 0.35 0.47 -0.02 0.00 0.00 0.00 0.00 47.33 48.13 1xlj h GLY 196 CO -0.65 -0.23 0.36 0.45 0.00 0.00 0.00 176.54 176.47 1xlj h HIS 197 N -0.49 0.94 -0.18 5.60 -0.00 -1.55 -2.50 115.15 116.96 1xlj h HIS 197 Ca 0.07 -0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 60.40 1xlj h HIS 197 Cb 0.60 -0.30 -0.01 0.00 -0.00 0.00 0.00 27.41 27.71 1xlj h HIS 197 CO -0.43 0.66 0.04 0.78 -0.00 0.00 0.00 177.93 178.98 1xlj h GLY 198 N 1.01 0.32 0.97 2.45 0.00 -0.88 -2.44 103.07 104.51 1xlj h GLY 198 Ca 0.24 -0.21 0.01 0.00 0.00 0.00 0.00 47.33 47.38 1xlj h GLY 198 CO -0.04 0.19 0.48 1.41 0.00 0.00 0.00 176.54 178.59 1xlj h LEU 199 N 0.10 0.82 -0.07 3.11 3.38 -0.80 -2.30 115.31 119.56 1xlj h LEU 199 Ca 0.06 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1xlj h LEU 199 Cb 0.29 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1xlj h LEU 199 CO 0.00 0.59 -0.04 0.00 0.09 0.00 0.00 178.44 179.08 1xlj h ALA 200 N 1.28 0.02 -0.71 1.53 0.00 -1.44 -3.04 119.26 116.90 1xlj h ALA 200 Ca 0.28 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.23 1xlj h ALA 200 Cb -0.08 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1xlj h ALA 200 CO -0.07 -0.51 0.46 0.35 0.00 0.00 0.00 179.25 179.48 1xlj h PHE 201 N -0.03 0.86 -0.98 0.00 3.04 -1.24 -2.67 116.94 115.92 1xlj h PHE 201 Ca 0.04 0.02 0.16 0.00 3.98 0.00 0.00 57.97 62.17 1xlj h PHE 201 Cb 0.09 -0.29 -0.09 0.00 2.56 0.00 0.00 35.95 38.23 1xlj h PHE 201 CO -0.14 0.52 0.61 0.82 -2.02 0.00 0.00 178.31 178.10 1xlj h ILE 202 N 0.91 0.81 0.00 1.41 2.04 -1.30 -2.10 117.51 119.29 1xlj h ILE 202 Ca 0.27 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1xlj h ILE 202 Cb -0.04 -0.08 0.00 0.00 -0.74 0.00 0.00 36.82 35.96 1xlj h ILE 202 CO -0.09 0.15 0.00 -0.62 0.00 0.00 0.00 178.15 177.59 1xlj n GLU 203 N -4.65 0.13 0.00 2.37 -0.58 -1.01 -2.21 120.64 114.68 1xlj n GLU 203 Ca 0.20 0.50 0.11 0.00 -0.42 0.00 0.00 57.16 57.55 1xlj n GLU 203 Cb 0.48 -1.82 0.06 0.00 -0.57 0.00 0.00 31.44 29.59 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 -2.07 1.38 -3.20 3.49 1.13 -0.79 -4.98 117.38 112.34 1xlj n GLN 204 Ca 0.01 -1.11 -0.36 0.00 -1.94 0.00 0.00 57.00 53.59 1xlj n GLN 204 Cb 0.12 -1.48 -0.06 0.00 0.11 0.00 0.00 30.24 28.93 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 -2.38 4.35 0.14 1.08 1.43 -0.94 -4.99 118.68 117.36 1xlj s LEU 205 Ca 0.21 1.28 -0.13 0.00 -1.03 0.00 0.00 54.13 54.47 1xlj s LEU 205 Cb 0.19 -3.44 -0.01 0.00 0.03 0.00 0.00 46.19 42.96 1xlj s LEU 205 CO 0.51 0.07 1.56 -0.08 0.23 0.00 0.00 176.35 178.64 1xlj h GLU 206 N 3.51 0.83 -1.29 1.70 4.57 -1.93 -3.29 114.58 118.67 1xlj h GLU 206 Ca -0.48 -0.30 -0.62 0.00 -1.18 0.00 0.00 59.36 56.78 1xlj h GLU 206 Cb 1.19 -0.06 -0.38 0.00 -0.16 0.00 0.00 28.75 29.35 1xlj h GLU 206 CO 0.65 0.92 -0.25 0.72 -1.18 0.00 0.00 179.01 179.87 1xlj n HIS 207 N -4.32 3.11 0.26 0.92 8.25 -1.26 -4.86 115.22 117.32 1xlj n HIS 207 Ca -0.00 -2.70 0.08 0.00 -0.26 0.00 0.00 57.72 54.84 1xlj n HIS 207 Cb 0.35 -0.53 0.39 0.00 1.12 0.00 0.00 29.99 31.32 1xlj n HIS 207 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xlj n GLY 208 N -0.62 -0.93 0.32 -1.41 0.00 -1.24 -3.01 105.19 98.30 1xlj n GLY 208 Ca 0.46 0.08 0.05 0.00 0.00 0.00 0.00 46.02 46.61 1xlj n GLY 208 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1xlj h ASP 209 N 0.00 0.53 -0.53 1.61 2.03 -1.91 -0.97 116.42 117.18 1xlj h ASP 209 Ca 0.00 -0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.29 1xlj h ASP 209 Cb 0.15 -0.13 0.00 0.00 -0.83 0.00 0.00 39.33 38.52 1xlj h ASP 209 CO 0.00 0.38 0.00 2.30 -1.03 0.00 0.00 179.24 180.89 1xlj n ILE 210 N -4.47 1.18 -4.77 4.15 -5.35 -1.16 -4.94 119.36 104.00 1xlj n ILE 210 Ca 0.05 -1.08 -0.33 0.00 -0.27 0.00 0.00 62.75 61.13 1xlj n ILE 210 Cb 0.11 0.41 -0.14 0.00 -1.74 0.00 0.00 39.64 38.28 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 -1.21 3.04 0.00 7.28 1.01 -0.37 -1.72 120.40 128.43 1xlj s VAL 211 Ca 0.38 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.70 1xlj s VAL 211 Cb 0.21 -2.28 0.00 0.00 0.00 0.00 0.00 36.38 34.32 1xlj s VAL 211 CO 0.23 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.47 1xlj n GLY 212 N 3.54 4.87 3.61 4.51 0.00 0.62 -4.89 105.19 117.44 1xlj n GLY 212 Ca -0.18 -1.34 -0.26 0.00 0.00 0.00 0.00 46.02 44.24 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 3.11 -0.51 0.99 2.01 0.10 -0.44 118.68 123.94 1xlj s LEU 213 Ca 0.00 -0.54 0.05 0.00 0.01 0.00 0.00 54.13 53.65 1xlj s LEU 213 Cb 0.00 -1.75 0.19 0.00 0.01 0.00 0.00 46.19 44.63 1xlj s LEU 213 CO 0.00 0.08 0.45 -3.20 1.01 0.00 0.00 176.35 174.69 1xlj n ASN 214 N -0.19 0.99 -4.81 2.29 5.15 0.92 -2.27 115.26 117.34 1xlj n ASN 214 Ca -0.10 -2.75 -0.33 0.00 -0.60 0.00 0.00 54.58 50.80 1xlj n ASN 214 Cb 0.56 -0.63 -0.03 0.00 -0.53 0.00 0.00 39.78 39.15 1xlj n ASN 214 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1xlj s PRO 215 N -0.79 3.77 -0.04 1.20 0.04 -1.26 -4.29 135.00 133.64 1xlj s PRO 215 Ca 0.32 1.25 0.03 0.00 0.04 0.00 0.00 61.00 62.64 1xlj s PRO 215 Cb 0.05 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.49 1xlj s PRO 215 CO -0.16 -0.44 -0.13 -2.00 0.04 0.00 0.00 177.00 174.31 1xlj s GLU 216 N -3.50 1.43 0.17 4.56 2.12 -1.26 -1.61 118.70 120.61 1xlj s GLU 216 Ca 0.65 -0.45 -0.26 0.00 0.36 0.00 0.00 54.97 55.27 1xlj s GLU 216 Cb -0.15 -1.26 0.04 0.00 0.26 0.00 0.00 34.13 33.02 1xlj s GLU 216 CO 0.24 0.16 1.57 1.15 -0.54 0.00 0.00 175.26 177.83 1xlj h THR 217 N 5.42 0.09 -0.66 -1.70 2.02 -1.76 -2.22 112.91 114.09 1xlj h THR 217 Ca -0.33 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 66.77 1xlj h THR 217 Cb 1.17 0.09 -0.03 0.00 -1.74 0.00 0.00 68.15 67.65 1xlj h THR 217 CO 0.48 0.00 0.07 1.23 0.37 0.00 0.00 175.52 177.67 1xlj h GLY 218 N -0.22 1.20 0.99 2.16 0.00 -1.87 -2.92 103.07 102.41 1xlj h GLY 218 Ca 0.18 -0.83 -0.01 0.00 0.00 0.00 0.00 47.33 46.67 1xlj h GLY 218 CO -0.69 0.77 -0.08 0.45 0.00 0.00 0.00 176.54 176.98 1xlj h HIS 219 N 1.03 -0.21 -0.78 5.60 3.86 -1.75 -2.15 115.15 120.75 1xlj h HIS 219 Ca 0.20 -0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.37 1xlj h HIS 219 Cb 0.49 0.07 -0.04 0.00 1.06 0.00 0.00 27.41 28.99 1xlj h HIS 219 CO 0.04 -0.12 0.36 0.93 0.86 0.00 0.00 177.93 180.00 1xlj h GLU 220 N -0.24 1.12 0.00 2.45 4.39 -1.47 -2.93 114.58 117.89 1xlj h GLU 220 Ca -0.02 -0.17 -0.01 0.00 0.34 0.00 0.00 59.36 59.51 1xlj h GLU 220 Cb 0.19 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 28.63 1xlj h GLU 220 CO 0.04 0.87 -0.03 1.96 -1.16 0.00 0.00 179.01 180.69 1xlj h GLN 221 N 1.11 0.00 0.00 2.33 4.20 -1.31 -2.47 115.11 118.98 1xlj h GLN 221 Ca 0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.98 1xlj h GLN 221 Cb 0.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1xlj h GLN 221 CO -0.03 0.03 0.00 -1.33 -0.67 0.00 0.00 178.83 176.83 1xlj n MET 222 N -3.18 0.22 0.00 1.46 2.81 -0.83 -1.88 117.12 115.72 1xlj n MET 222 Ca -0.01 0.39 0.06 0.00 -1.81 0.00 0.00 57.70 56.34 1xlj n MET 222 Cb 0.23 -1.88 0.03 0.00 -0.71 0.00 0.00 33.22 30.89 1xlj n MET 222 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1xlj n ALA 223 N -1.79 2.71 -2.14 3.04 0.00 -1.16 -4.64 120.51 116.53 1xlj n ALA 223 Ca 0.03 -0.54 -0.12 0.00 0.00 0.00 0.00 53.44 52.81 1xlj n ALA 223 Cb 0.27 -0.43 -0.01 0.00 0.00 0.00 0.00 19.45 19.28 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 0.85 0.01 3.93 0.00 0.00 -0.79 -5.03 105.19 104.17 1xlj n GLY 224 Ca 0.06 -0.39 -0.25 0.00 0.00 0.00 0.00 46.02 45.44 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 -3.37 3.14 -0.45 0.99 1.43 -0.94 -4.96 118.68 114.53 1xlj s LEU 225 Ca 0.00 0.47 -0.19 0.00 -1.03 0.00 0.00 54.13 53.37 1xlj s LEU 225 Cb 0.00 -3.25 0.03 0.00 0.03 0.00 0.00 46.19 43.00 1xlj s LEU 225 CO 0.00 -1.21 0.58 0.21 0.23 0.00 0.00 176.35 176.16 1xlj s ASN 226 N -4.38 6.27 0.18 2.29 3.84 -1.26 -4.23 114.94 117.63 1xlj s ASN 226 Ca 0.56 -0.55 -0.13 0.00 0.21 0.00 0.00 52.86 52.94 1xlj s ASN 226 Cb -0.11 -2.29 0.13 0.00 -0.55 0.00 0.00 41.25 38.43 1xlj s ASN 226 CO 0.43 -0.75 1.79 0.15 -2.79 0.00 0.00 177.10 175.93 1xlj h PHE 227 N 8.86 0.48 -0.93 0.43 3.57 -1.92 -1.09 116.94 126.36 1xlj h PHE 227 Ca -0.26 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.31 1xlj h PHE 227 Cb 1.10 -0.14 -0.06 0.00 2.79 0.00 0.00 35.95 39.64 1xlj h PHE 227 CO 0.70 0.24 0.61 1.15 -2.23 0.00 0.00 178.31 178.78 1xlj h THR 228 N 0.51 1.11 -0.37 4.41 2.02 -1.93 -0.60 112.91 118.07 1xlj h THR 228 Ca 0.22 -0.38 -0.16 0.00 0.77 0.00 0.00 66.41 66.85 1xlj h THR 228 Cb 0.11 -0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 66.42 1xlj h THR 228 CO -0.14 0.20 -0.42 0.45 0.37 0.00 0.00 175.52 175.98 1xlj h HIS 229 N 1.10 1.12 -0.40 3.16 3.86 -1.77 -2.42 115.15 119.80 1xlj h HIS 229 Ca 0.39 -0.35 -0.04 0.00 -1.16 0.00 0.00 60.37 59.21 1xlj h HIS 229 Cb 0.12 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.34 1xlj h HIS 229 CO -0.00 1.18 0.09 0.78 0.86 0.00 0.00 177.93 180.83 1xlj h GLY 230 N 0.77 0.69 1.88 2.45 0.00 -0.32 -1.71 103.07 106.83 1xlj h GLY 230 Ca 0.05 -0.44 -0.11 0.00 0.00 0.00 0.00 47.33 46.83 1xlj h GLY 230 CO 0.10 0.41 -0.45 0.16 0.00 0.00 0.00 176.54 176.76 1xlj h ILE 231 N 0.50 1.33 -0.49 2.60 3.07 -1.19 -1.58 117.51 121.75 1xlj h ILE 231 Ca 0.12 -1.61 -0.08 0.00 1.55 0.00 0.00 64.86 64.85 1xlj h ILE 231 Cb 0.33 1.79 -0.02 0.00 -0.27 0.00 0.00 36.82 38.65 1xlj h ILE 231 CO 0.00 0.47 -0.01 0.00 -1.05 0.00 0.00 178.15 177.57 1xlj h ALA 232 N 1.42 1.06 -0.16 0.16 0.00 -1.26 0.29 119.26 120.78 1xlj h ALA 232 Ca 0.01 -0.27 -0.17 0.00 0.00 0.00 0.00 54.91 54.47 1xlj h ALA 232 Cb 0.85 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1xlj h ALA 232 CO 0.07 0.59 -0.62 0.37 0.00 0.00 0.00 179.25 179.66 1xlj h GLN 233 N 0.77 0.54 -0.36 0.00 4.15 -0.65 -2.15 115.11 117.41 1xlj h GLN 233 Ca 0.15 -0.38 -0.04 0.00 0.77 0.00 0.00 58.65 59.15 1xlj h GLN 233 Cb 0.48 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.21 1xlj h GLN 233 CO 0.02 0.99 0.07 0.00 -1.93 0.00 0.00 178.83 177.98 1xlj h ALA 234 N 0.92 0.48 0.05 3.38 0.00 -0.55 -2.71 119.26 120.83 1xlj h ALA 234 Ca -0.01 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1xlj h ALA 234 Cb 1.18 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 1xlj h ALA 234 CO 0.11 0.18 -0.04 -0.07 0.00 0.00 0.00 179.25 179.44 1xlj h LEU 235 N 0.44 -0.09 -0.98 0.00 3.38 -0.42 0.19 115.31 117.83 1xlj h LEU 235 Ca 0.11 0.01 0.17 0.00 0.09 0.00 0.00 57.88 58.26 1xlj h LEU 235 Cb 0.35 0.03 -0.10 0.00 0.09 0.00 0.00 40.66 41.03 1xlj h LEU 235 CO 0.01 -0.06 0.59 -0.25 0.09 0.00 0.00 178.44 178.81 1xlj h TRP 236 N -0.09 1.04 -0.00 1.13 7.01 -1.36 0.19 115.95 123.86 1xlj h TRP 236 Ca -0.00 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.03 1xlj h TRP 236 Cb 0.08 -0.31 0.00 0.00 -2.10 0.00 0.00 29.16 26.83 1xlj h TRP 236 CO -0.09 0.26 -0.06 0.00 -2.79 0.00 0.00 178.44 175.76 1xlj n ALA 237 N -2.35 2.69 -3.51 2.65 0.00 -1.03 -4.93 120.51 114.03 1xlj n ALA 237 Ca 0.22 -0.26 -0.22 0.00 0.00 0.00 0.00 53.44 53.18 1xlj n ALA 237 Cb 0.52 -1.37 0.05 0.00 0.00 0.00 0.00 19.45 18.65 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 -0.86 -3.07 -0.21 0.00 1.02 0.65 -4.94 120.64 113.23 1xlj n GLU 238 Ca 0.17 0.68 0.02 0.00 -0.02 0.00 0.00 57.16 58.02 1xlj n GLU 238 Cb 0.24 -5.17 0.03 0.00 -0.02 0.00 0.00 31.44 26.53 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 -3.87 0.74 -3.06 3.49 4.76 0.66 -4.96 118.16 115.92 1xlj n LYS 239 Ca -0.16 -1.35 -0.45 0.00 -2.87 0.00 0.00 58.31 53.48 1xlj n LYS 239 Cb 0.63 -0.82 -0.01 0.00 -1.84 0.00 0.00 35.03 32.99 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 -0.86 5.52 0.13 -0.35 2.96 -1.22 0.01 118.68 124.87 1xlj s LEU 240 Ca 0.08 -2.66 0.10 0.00 -0.22 0.00 0.00 54.13 51.43 1xlj s LEU 240 Cb 0.07 -2.34 -0.14 0.00 0.50 0.00 0.00 46.19 44.27 1xlj s LEU 240 CO 0.01 -0.78 1.19 -0.26 -1.32 0.00 0.00 176.35 175.20 1xlj h PHE 241 N 7.84 0.00 -3.19 5.38 -1.00 -1.88 -3.46 116.94 120.63 1xlj h PHE 241 Ca 0.20 0.00 0.02 0.00 2.81 0.00 0.00 57.97 61.00 1xlj h PHE 241 Cb 0.96 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.47 1xlj h PHE 241 CO 1.07 0.85 0.14 -1.58 -1.61 0.00 0.00 178.31 177.18 1xlj s HIS 242 N -2.77 0.02 -0.12 -0.55 2.46 -0.96 -4.84 115.29 108.53 1xlj s HIS 242 Ca 0.01 -0.47 -0.19 0.00 0.47 0.00 0.00 55.06 54.87 1xlj s HIS 242 Cb 0.09 0.58 0.05 0.00 -0.13 0.00 0.00 32.58 33.17 1xlj s HIS 242 CO 0.80 -1.22 0.49 -1.50 -2.47 0.00 0.00 174.74 170.84 1xlj s ILE 243 N -3.72 0.01 -0.21 0.89 2.07 -1.26 -4.00 121.20 114.98 1xlj s ILE 243 Ca 0.15 -0.12 0.01 0.00 -1.41 0.00 0.00 60.65 59.29 1xlj s ILE 243 Cb -0.04 -0.73 0.03 0.00 0.13 0.00 0.00 42.46 41.85 1xlj s ILE 243 CO 0.08 -0.06 -0.16 -1.81 -1.91 0.00 0.00 174.94 171.08 1xlj s ASP 244 N -0.38 3.63 -0.14 4.50 1.01 -0.63 -3.61 116.67 121.05 1xlj s ASP 244 Ca -0.05 -0.89 -0.05 0.00 0.71 0.00 0.00 52.55 52.27 1xlj s ASP 244 Cb -0.03 -1.52 -0.04 0.00 1.01 0.00 0.00 42.92 42.34 1xlj s ASP 244 CO 0.03 -0.07 0.04 -0.76 0.21 0.00 0.00 175.17 174.62 1xlj s LEU 245 N 1.24 3.72 0.00 1.23 1.43 0.16 -2.28 118.68 124.19 1xlj s LEU 245 Ca 0.00 0.12 0.00 0.00 -1.03 0.00 0.00 54.13 53.22 1xlj s LEU 245 Cb -0.15 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.17 1xlj s LEU 245 CO -0.10 0.27 0.00 -0.46 0.23 0.00 0.00 176.35 176.30 1xlj n ASN 246 N 2.86 0.00 -4.10 2.29 0.23 -1.26 -2.16 115.26 113.11 1xlj n ASN 246 Ca -0.18 -0.96 -0.17 0.00 -0.53 0.00 0.00 54.58 52.74 1xlj n ASN 246 Cb 0.53 0.00 -0.13 0.00 -2.08 0.00 0.00 39.78 38.10 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 -1.72 0.66 -0.02 4.83 0.00 0.65 -4.41 107.32 107.31 1xlj s GLY 247 Ca 0.00 -0.78 0.01 0.00 0.00 0.00 0.00 44.72 43.95 1xlj s GLY 247 CO 0.00 -0.78 -0.01 1.62 0.00 0.00 0.00 173.10 173.92 1xlj s GLN 248 N -1.28 0.27 -0.85 2.90 2.00 -1.26 -1.16 119.66 120.28 1xlj s GLN 248 Ca -0.03 -0.01 0.01 0.00 -2.00 0.00 0.00 55.36 53.34 1xlj s GLN 248 Cb -0.08 -0.36 0.28 0.00 0.80 0.00 0.00 33.01 33.64 1xlj s GLN 248 CO 0.01 -0.05 1.12 0.54 -0.50 0.00 0.00 175.29 176.41 1xlj n ARG 249 N 3.62 3.51 0.00 1.67 1.74 -1.26 -3.13 116.66 122.81 1xlj n ARG 249 Ca -0.21 -4.62 0.00 0.00 -0.77 0.00 0.00 57.85 52.25 1xlj n ARG 249 Cb 0.54 -2.38 0.00 0.00 -1.02 0.00 0.00 32.46 29.60 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 1.04 -3.55 3.55 -0.13 0.00 -1.26 -4.89 105.19 99.95 1xlj n GLY 250 Ca 0.28 -2.05 -0.42 0.00 0.00 0.00 0.00 46.02 43.83 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 -0.73 3.95 0.00 -0.61 1.01 -1.26 -4.56 121.20 119.00 1xlj s ILE 251 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 60.65 61.11 1xlj s ILE 251 Cb 0.00 -4.80 0.00 0.00 0.01 0.00 0.00 42.46 37.67 1xlj s ILE 251 CO 0.00 -1.58 0.00 2.29 0.00 0.00 0.00 174.94 175.65 1xlj n LYS 252 N 8.71 0.00 -1.31 2.79 2.85 -1.26 -5.08 118.16 124.86 1xlj n LYS 252 Ca 0.04 0.00 -0.35 0.00 -1.05 0.00 0.00 58.31 56.95 1xlj n LYS 252 Cb 0.48 0.00 0.10 0.00 -0.65 0.00 0.00 35.03 34.96 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 0.99 -2.35 5.58 4.11 -1.26 -4.89 117.16 119.35 1xlj n TYR 253 Ca 0.00 0.40 -0.43 0.00 -0.00 0.00 0.00 57.90 57.87 1xlj n TYR 253 Cb 0.00 -2.11 -0.02 0.00 -0.00 0.00 0.00 39.34 37.21 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 -1.78 6.82 0.02 9.48 -4.77 -1.26 -4.90 116.67 120.27 1xlj s ASP 254 Ca 0.74 1.67 -0.13 0.00 -3.30 0.00 0.00 52.55 51.54 1xlj s ASP 254 Cb -0.33 -2.54 -0.34 0.00 -1.09 0.00 0.00 42.92 38.63 1xlj s ASP 254 CO 0.50 -0.87 0.93 1.56 0.70 0.00 0.00 175.17 177.98 1xlj h GLN 255 N 8.75 0.47 -5.39 2.11 4.20 -1.90 -3.49 115.11 119.86 1xlj h GLN 255 Ca -0.28 -0.80 -0.31 0.00 0.06 0.00 0.00 58.65 57.31 1xlj h GLN 255 Cb 1.12 0.30 0.15 0.00 0.30 0.00 0.00 27.48 29.35 1xlj h GLN 255 CO 0.98 1.38 -0.70 -0.25 -0.67 0.00 0.00 178.83 179.57 1xlj n ASP 256 N -3.65 -2.65 -4.83 1.46 8.00 -1.23 -4.69 116.55 108.95 1xlj n ASP 256 Ca -0.18 -0.56 -0.29 0.00 0.71 0.00 0.00 54.79 54.47 1xlj n ASP 256 Cb 1.09 -4.76 0.11 0.00 -0.02 0.00 0.00 41.12 37.53 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 -6.15 2.37 0.52 0.64 1.43 -0.31 -0.10 118.68 117.09 1xlj s LEU 257 Ca 0.08 0.80 -0.22 0.00 -1.03 0.00 0.00 54.13 53.77 1xlj s LEU 257 Cb -0.04 -3.22 -0.05 0.00 0.03 0.00 0.00 46.19 42.90 1xlj s LEU 257 CO 0.67 -2.13 1.28 -0.69 0.23 0.00 0.00 176.35 175.72 1xlj s VAL 258 N -3.51 2.46 0.16 -1.59 1.01 -1.26 -0.25 120.40 117.41 1xlj s VAL 258 Ca 0.63 0.34 -0.31 0.00 0.00 0.00 0.00 61.98 62.63 1xlj s VAL 258 Cb -0.12 -3.17 -0.11 0.00 0.00 0.00 0.00 36.38 32.99 1xlj s VAL 258 CO 0.50 -0.01 1.80 0.12 0.00 0.00 0.00 175.10 177.51 1xlj s PHE 259 N -1.41 2.44 0.00 5.22 5.36 -1.26 -1.25 117.98 127.07 1xlj s PHE 259 Ca 0.70 0.11 0.00 0.00 -0.96 0.00 0.00 56.93 56.78 1xlj s PHE 259 Cb -0.36 -4.17 0.00 0.00 -0.34 0.00 0.00 43.02 38.15 1xlj s PHE 259 CO 0.42 -4.69 0.00 0.41 -1.46 0.00 0.00 175.22 169.90 1xlj n GLY 260 N 4.14 0.51 0.33 13.12 0.00 -1.26 -4.72 105.19 117.32 1xlj n GLY 260 Ca 0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.32 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 -2.00 0.04 0.00 1.61 8.25 -0.38 -4.51 115.22 118.23 1xlj n HIS 261 Ca 0.00 -0.02 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 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 1.08 1.36 3.53 -1.41 0.00 -1.26 -4.85 105.19 103.64 1xlj n GLY 262 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 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 0.47 6.36 0.03 1.61 -1.08 -1.18 -4.90 116.67 117.98 1xlj s ASP 263 Ca 0.00 -0.27 -0.29 0.00 -0.52 0.00 0.00 52.55 51.47 1xlj s ASP 263 Cb 0.00 -2.45 -0.17 0.00 -1.46 0.00 0.00 42.92 38.84 1xlj s ASP 263 CO 0.00 -1.23 1.31 0.25 0.52 0.00 0.00 175.17 176.03 1xlj h LEU 264 N 11.00 -0.74 -0.65 -1.34 5.85 -1.95 -1.99 115.31 125.48 1xlj h LEU 264 Ca -0.26 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.50 1xlj h LEU 264 Cb 1.07 0.19 -0.05 0.00 0.37 0.00 0.00 40.66 42.24 1xlj h LEU 264 CO 1.09 -0.41 0.37 0.74 -0.34 0.00 0.00 178.44 179.89 1xlj h THR 265 N -1.08 0.99 -0.59 1.05 2.02 -1.95 0.15 112.91 113.50 1xlj h THR 265 Ca -0.09 -0.24 -0.00 0.00 0.77 0.00 0.00 66.41 66.85 1xlj h THR 265 Cb 0.71 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.33 1xlj h THR 265 CO 0.15 0.13 0.35 -1.28 0.37 0.00 0.00 175.52 175.24 1xlj h SER 266 N 0.70 0.72 -0.29 4.18 0.87 -1.98 -0.91 113.55 116.84 1xlj h SER 266 Ca 0.29 -0.06 0.04 0.00 -1.23 0.00 0.00 61.79 60.82 1xlj h SER 266 Cb 0.15 -0.18 -0.04 0.00 -0.44 0.00 0.00 62.40 61.89 1xlj h SER 266 CO -0.16 0.57 0.06 0.00 -0.53 0.00 0.00 176.83 176.76 1xlj h ALA 267 N 1.17 0.30 -0.17 6.23 0.00 -0.45 -1.22 119.26 125.12 1xlj h ALA 267 Ca 0.21 0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.23 1xlj h ALA 267 Cb -0.01 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 1xlj h ALA 267 CO -0.04 -0.35 -0.25 0.35 0.00 0.00 0.00 179.25 178.96 1xlj h PHE 268 N 0.17 -0.67 0.00 0.00 3.57 -0.35 -1.51 116.94 118.15 1xlj h PHE 268 Ca 0.13 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.61 1xlj h PHE 268 Cb 0.14 0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.19 1xlj h PHE 268 CO -0.17 -0.33 -0.27 0.74 -2.23 0.00 0.00 178.31 176.05 1xlj h PHE 269 N -0.29 0.00 -0.12 0.41 0.04 -0.77 -1.32 116.94 114.89 1xlj h PHE 269 Ca 0.11 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.82 1xlj h PHE 269 Cb 0.47 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.62 1xlj h PHE 269 CO -0.37 0.27 -0.19 1.15 -0.60 0.00 0.00 178.31 178.57 1xlj h THR 270 N 0.00 1.38 -0.02 -1.55 2.02 -0.74 -2.77 112.91 111.23 1xlj h THR 270 Ca -0.00 -1.43 0.00 0.00 0.77 0.00 0.00 66.41 65.75 1xlj h THR 270 Cb 0.63 2.03 -0.00 0.00 -1.74 0.00 0.00 68.15 69.07 1xlj h THR 270 CO 0.04 0.42 0.01 0.58 0.37 0.00 0.00 175.52 176.93 1xlj h VAL 271 N -0.08 1.00 -0.60 3.16 2.07 -1.13 0.24 116.25 120.91 1xlj h VAL 271 Ca 0.01 -0.01 0.12 0.00 0.82 0.00 0.00 66.70 67.65 1xlj h VAL 271 Cb 0.76 0.98 -0.11 0.00 -1.52 0.00 0.00 31.29 31.40 1xlj h VAL 271 CO 0.04 0.00 -0.10 -0.78 0.02 0.00 0.00 177.57 176.75 1xlj h ASP 272 N 0.02 -0.47 -0.28 0.57 3.58 -1.25 0.31 116.42 118.89 1xlj h ASP 272 Ca 0.01 0.17 -0.02 0.00 0.42 0.00 0.00 57.03 57.61 1xlj h ASP 272 Cb 0.00 0.34 -0.01 0.00 1.72 0.00 0.00 39.33 41.38 1xlj h ASP 272 CO -0.01 -0.17 0.11 0.25 -2.88 0.00 0.00 179.24 176.54 1xlj h LEU 273 N 0.03 0.39 -0.26 2.28 7.12 -1.15 1.04 115.31 124.75 1xlj h LEU 273 Ca 0.30 -0.17 -0.07 0.00 0.13 0.00 0.00 57.88 58.06 1xlj h LEU 273 Cb 0.46 -0.10 -0.01 0.00 -0.53 0.00 0.00 40.66 40.48 1xlj h LEU 273 CO -0.58 0.46 -0.12 -0.07 -0.13 0.00 0.00 178.44 178.00 1xlj h LEU 274 N 0.30 0.56 0.00 2.25 3.38 0.10 -2.28 115.31 119.62 1xlj h LEU 274 Ca 0.09 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 1xlj h LEU 274 Cb 0.20 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1xlj h LEU 274 CO -0.01 0.84 -0.07 -0.33 0.09 0.00 0.00 178.44 178.96 1xlj h GLU 275 N 0.28 0.00 0.00 1.13 4.39 -0.45 -3.39 114.58 116.54 1xlj h GLU 275 Ca 0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1xlj h GLU 275 Cb 0.62 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.27 1xlj h GLU 275 CO 0.04 0.67 -0.37 0.09 -1.16 0.00 0.00 179.01 178.28 1xlj n ASN 276 N -4.65 0.75 -0.17 1.42 3.02 0.36 -5.05 115.26 110.93 1xlj n ASN 276 Ca -0.08 0.31 0.00 0.00 -0.03 0.00 0.00 54.58 54.78 1xlj n ASN 276 Cb 0.34 -0.24 0.00 0.00 -0.61 0.00 0.00 39.78 39.27 1xlj n ASN 276 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xlj n GLY 277 N 1.33 -1.32 3.76 7.41 0.00 -0.86 -4.80 105.19 110.71 1xlj n GLY 277 Ca 0.04 -1.24 -0.40 0.00 0.00 0.00 0.00 46.02 44.43 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 3.82 0.36 1.61 0.08 -1.26 -4.57 117.98 118.02 1xlj s PHE 278 Ca 0.00 1.55 0.14 0.00 0.12 0.00 0.00 56.93 58.74 1xlj s PHE 278 Cb 0.00 -2.79 1.00 0.00 -0.57 0.00 0.00 43.02 40.66 1xlj s PHE 278 CO 0.00 0.40 1.74 -1.35 -0.10 0.00 0.00 175.22 175.91 1xlj h PRO 279 N 4.99 0.47 -0.64 0.24 0.11 -1.97 0.46 132.00 135.66 1xlj h PRO 279 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1xlj h PRO 279 Cb 1.21 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1xlj h PRO 279 CO 0.68 0.31 0.00 0.09 -0.21 0.00 0.00 178.00 178.87 1xlj n ASN 280 N -4.76 4.91 0.00 -2.05 3.02 -1.26 -5.05 115.26 110.07 1xlj n ASN 280 Ca 0.26 -2.55 0.00 0.00 -0.03 0.00 0.00 54.58 52.26 1xlj n ASN 280 Cb 0.82 -0.60 0.00 0.00 -0.61 0.00 0.00 39.78 39.39 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 1.01 0.18 0.00 7.41 0.00 0.16 -5.09 105.19 108.85 1xlj n GLY 281 Ca 0.26 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.44 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 0.38 1.45 3.69 -0.02 0.00 -1.26 -4.53 105.19 104.89 1xlj n GLY 282 Ca 0.00 -1.84 -0.31 0.00 0.00 0.00 0.00 46.02 43.88 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 -1.33 1.22 0.07 1.61 0.04 -1.26 -4.82 135.00 130.53 1xlj s PRO 283 Ca 0.00 1.30 0.05 0.00 0.04 0.00 0.00 61.00 62.39 1xlj s PRO 283 Cb 0.00 -1.77 -0.03 0.00 0.04 0.00 0.00 34.50 32.74 1xlj s PRO 283 CO 0.00 -2.41 -0.13 0.15 0.04 0.00 0.00 177.00 174.65 1xlj s LYS 284 N -4.74 0.79 -0.13 4.56 -0.14 -1.26 -4.63 119.74 114.20 1xlj s LYS 284 Ca 0.65 -0.95 -0.21 0.00 -1.36 0.00 0.00 55.97 54.10 1xlj s LYS 284 Cb -0.21 -0.75 -0.03 0.00 -1.68 0.00 0.00 37.83 35.15 1xlj s LYS 284 CO 0.58 0.16 0.62 -0.47 -0.76 0.00 0.00 175.35 175.49 1xlj s TYR 285 N -1.35 3.49 -0.07 3.18 5.04 -1.26 -4.99 117.35 121.38 1xlj s TYR 285 Ca -0.02 1.05 0.01 0.00 -2.44 0.00 0.00 57.07 55.67 1xlj s TYR 285 Cb -0.10 -2.74 0.01 0.00 0.35 0.00 0.00 41.96 39.48 1xlj s TYR 285 CO 0.02 0.01 0.61 0.25 -1.34 0.00 0.00 175.55 175.10 1xlj n THR 286 N 4.07 0.17 -0.56 4.34 -2.24 -1.26 -4.97 114.28 113.84 1xlj n THR 286 Ca -0.03 -0.59 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 1xlj n THR 286 Cb 0.51 0.92 0.00 0.00 -2.10 0.00 0.00 70.33 69.66 1xlj n THR 286 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xlj n GLY 287 N -0.05 -1.86 3.75 3.38 0.00 -1.26 -5.02 105.19 104.13 1xlj n GLY 287 Ca 0.00 -1.53 -0.34 0.00 0.00 0.00 0.00 46.02 44.15 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 -2.43 2.62 -0.61 1.61 0.04 -1.26 -4.94 135.00 130.02 1xlj s PRO 288 Ca 0.00 1.68 -0.09 0.00 0.04 0.00 0.00 61.00 62.63 1xlj s PRO 288 Cb 0.00 -1.90 0.16 0.00 0.04 0.00 0.00 34.50 32.80 1xlj s PRO 288 CO 0.00 -1.45 0.49 1.03 0.04 0.00 0.00 177.00 177.12 1xlj s ARG 289 N -3.75 2.84 -0.19 4.56 3.00 -0.42 -4.47 118.95 120.53 1xlj s ARG 289 Ca 0.73 -2.15 -0.09 0.00 0.00 0.00 0.00 55.73 54.23 1xlj s ARG 289 Cb -0.27 -4.04 -0.04 0.00 0.00 0.00 0.00 34.95 30.60 1xlj s ARG 289 CO 0.40 -1.23 0.09 -1.58 0.00 0.00 0.00 175.30 172.98 1xlj s HIS 290 N 0.69 3.33 -0.32 -0.53 2.46 -1.24 -1.85 115.29 117.83 1xlj s HIS 290 Ca 0.12 0.19 -0.11 0.00 0.47 0.00 0.00 55.06 55.73 1xlj s HIS 290 Cb -0.21 -2.11 -0.01 0.00 -0.13 0.00 0.00 32.58 30.13 1xlj s HIS 290 CO -0.03 0.22 0.18 -0.06 -2.47 0.00 0.00 174.74 172.58 1xlj s PHE 291 N 0.34 3.20 -0.59 3.88 0.08 -0.97 0.41 117.98 124.32 1xlj s PHE 291 Ca 0.05 -0.49 0.02 0.00 0.12 0.00 0.00 56.93 56.64 1xlj s PHE 291 Cb -0.12 -2.40 0.15 0.00 -0.57 0.00 0.00 43.02 40.08 1xlj s PHE 291 CO -0.01 -0.44 0.36 0.34 -0.10 0.00 0.00 175.22 175.37 1xlj s ASP 292 N 1.64 4.68 0.28 1.36 2.15 -0.92 -3.85 116.67 122.02 1xlj s ASP 292 Ca 0.05 -3.13 0.03 0.00 0.43 0.00 0.00 52.55 49.93 1xlj s ASP 292 Cb -0.17 -1.70 -0.04 0.00 -0.30 0.00 0.00 42.92 40.71 1xlj s ASP 292 CO 0.08 -0.24 0.19 -0.72 -0.17 0.00 0.00 175.17 174.31 1xlj s TYR 293 N -0.46 1.53 -0.07 -5.34 1.13 -1.26 -4.58 117.35 108.30 1xlj s TYR 293 Ca 0.19 -1.47 0.00 0.00 -1.41 0.00 0.00 57.07 54.38 1xlj s TYR 293 Cb -0.21 -0.73 0.02 0.00 -1.10 0.00 0.00 41.96 39.94 1xlj s TYR 293 CO -0.04 -0.67 -0.06 0.15 -2.51 0.00 0.00 175.55 172.43 1xlj s LYS 294 N -3.79 1.12 0.06 -3.49 1.02 0.85 -4.43 119.74 111.08 1xlj s LYS 294 Ca 0.38 -0.16 -0.31 0.00 0.02 0.00 0.00 55.97 55.91 1xlj s LYS 294 Cb 0.05 -1.15 -0.08 0.00 -0.52 0.00 0.00 37.83 36.12 1xlj s LYS 294 CO 0.19 -0.15 1.70 -2.14 -0.92 0.00 0.00 175.35 174.04 1xlj s PRO 295 N 1.26 4.18 0.34 -1.68 0.02 -1.26 -4.63 135.00 133.23 1xlj s PRO 295 Ca -0.05 2.37 -0.25 0.00 0.02 0.00 0.00 61.00 63.09 1xlj s PRO 295 Cb -0.14 -3.70 -0.14 0.00 0.02 0.00 0.00 34.50 30.54 1xlj s PRO 295 CO -0.02 -0.78 0.69 0.43 -0.33 0.00 0.00 177.00 176.99 1xlj n SER 296 N 5.98 -0.24 0.00 2.53 7.64 -1.26 -4.84 113.62 123.43 1xlj n SER 296 Ca 0.17 1.04 0.02 0.00 1.01 0.00 0.00 58.87 61.11 1xlj n SER 296 Cb 0.41 -1.14 0.11 0.00 -1.01 0.00 0.00 64.21 62.58 1xlj n SER 296 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1xlj n ARG 297 N 0.71 0.01 0.16 1.43 1.85 -1.26 -2.71 116.66 116.86 1xlj n ARG 297 Ca 0.12 0.39 0.04 0.00 -1.00 0.00 0.00 57.85 57.40 1xlj n ARG 297 Cb 0.34 -1.50 0.19 0.00 -1.05 0.00 0.00 32.46 30.44 1xlj n ARG 297 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 1xlj h THR 298 N 0.00 0.90 -3.16 8.89 1.35 -1.98 -3.45 112.91 115.45 1xlj h THR 298 Ca 0.00 -1.90 -0.58 0.00 -0.55 0.00 0.00 66.41 63.38 1xlj h THR 298 Cb 0.08 2.18 -0.05 0.00 -1.73 0.00 0.00 68.15 68.64 1xlj h THR 298 CO 0.00 0.44 -0.13 -1.81 -0.25 0.00 0.00 175.52 173.77 1xlj s ASP 299 N -6.44 6.86 0.66 5.36 1.11 -1.10 -5.11 116.67 118.00 1xlj s ASP 299 Ca 0.02 1.05 0.00 0.00 0.18 0.00 0.00 52.55 53.79 1xlj s ASP 299 Cb 0.09 -2.28 0.00 0.00 1.07 0.00 0.00 42.92 41.81 1xlj s ASP 299 CO 0.72 0.23 0.00 0.61 1.18 0.00 0.00 175.17 177.91 1xlj n GLY 300 N 1.39 -0.37 0.26 0.21 0.00 -1.26 -4.82 105.19 100.60 1xlj n GLY 300 Ca -0.10 -1.77 0.09 0.00 0.00 0.00 0.00 46.02 44.24 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 -0.66 0.00 -0.41 1.61 0.05 -1.99 -1.40 116.97 114.17 1xlj h TYR 301 Ca 0.00 0.00 0.04 0.00 0.05 0.00 0.00 58.73 58.82 1xlj h TYR 301 Cb 0.00 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 37.70 1xlj h TYR 301 CO 0.00 0.04 0.18 -0.44 -1.05 0.00 0.00 178.16 176.89 1xlj h ASP 302 N 0.00 0.24 -1.00 3.88 3.32 -2.01 -1.89 116.42 118.96 1xlj h ASP 302 Ca -0.00 0.03 0.08 0.00 0.02 0.00 0.00 57.03 57.16 1xlj h ASP 302 Cb 0.07 -0.01 -0.07 0.00 0.22 0.00 0.00 39.33 39.54 1xlj h ASP 302 CO 0.00 0.18 0.64 1.23 -1.72 0.00 0.00 179.24 179.58 1xlj h GLY 303 N 0.37 1.56 0.94 2.75 0.00 -1.60 -1.66 103.07 105.44 1xlj h GLY 303 Ca 0.18 -0.46 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 1xlj h GLY 303 CO -0.15 0.29 -0.16 -2.08 0.00 0.00 0.00 176.54 174.44 1xlj h VAL 304 N 1.13 0.66 -0.16 4.60 2.07 -1.11 0.78 116.25 124.23 1xlj h VAL 304 Ca 0.45 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.84 1xlj h VAL 304 Cb 0.25 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1xlj h VAL 304 CO -0.20 0.00 -0.46 -0.50 0.02 0.00 0.00 177.57 176.43 1xlj h TRP 305 N -0.42 0.47 0.18 1.57 4.06 -1.30 -1.16 115.95 119.35 1xlj h TRP 305 Ca -0.03 -0.14 0.01 0.00 2.06 0.00 0.00 58.89 60.79 1xlj h TRP 305 Cb 0.34 -0.10 -0.03 0.00 -1.00 0.00 0.00 29.16 28.38 1xlj h TRP 305 CO -0.08 0.78 -0.28 -0.44 -3.56 0.00 0.00 178.44 174.86 1xlj h ASP 306 N 0.32 -0.79 -0.94 -3.49 3.32 -1.06 -1.05 116.42 112.72 1xlj h ASP 306 Ca 0.02 0.08 0.03 0.00 0.02 0.00 0.00 57.03 57.18 1xlj h ASP 306 Cb 0.93 0.29 -0.05 0.00 0.22 0.00 0.00 39.33 40.72 1xlj h ASP 306 CO 0.08 -0.38 0.62 0.77 -1.72 0.00 0.00 179.24 178.60 1xlj h SER 307 N -0.53 1.05 -0.35 6.45 4.64 -0.60 0.48 113.55 124.67 1xlj h SER 307 Ca 0.01 -0.02 0.02 0.00 -0.47 0.00 0.00 61.79 61.34 1xlj h SER 307 Cb 0.53 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 62.35 1xlj h SER 307 CO -0.12 0.73 0.20 0.00 -0.87 0.00 0.00 176.83 176.77 1xlj h ALA 308 N 1.37 0.44 -0.14 5.18 0.00 -0.92 -1.57 119.26 123.62 1xlj h ALA 308 Ca 0.36 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.27 1xlj h ALA 308 Cb -0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1xlj h ALA 308 CO -0.10 -0.16 0.08 -0.22 0.00 0.00 0.00 179.25 178.85 1xlj h LYS 309 N 0.40 0.20 -0.64 0.00 3.64 -0.58 -3.09 116.57 116.50 1xlj h LYS 309 Ca 0.14 -0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.54 1xlj h LYS 309 Cb 0.02 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 31.75 1xlj h LYS 309 CO -0.08 0.20 0.38 0.00 -2.27 0.00 0.00 179.45 177.68 1xlj h ALA 310 N 0.98 0.85 -0.43 5.00 0.00 0.32 -2.11 119.26 123.87 1xlj h ALA 310 Ca 0.05 0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.05 1xlj h ALA 310 Cb 0.06 -0.16 -0.09 0.00 0.00 0.00 0.00 17.79 17.60 1xlj h ALA 310 CO -0.01 0.08 -0.28 -0.91 0.00 0.00 0.00 179.25 178.13 1xlj h ASN 311 N 0.72 -0.95 -0.28 0.00 2.35 -1.21 0.14 115.58 116.35 1xlj h ASN 311 Ca 0.27 0.19 -0.12 0.00 -0.55 0.00 0.00 56.30 56.09 1xlj h ASN 311 Cb 0.11 0.47 -0.01 0.00 0.05 0.00 0.00 38.32 38.93 1xlj h ASN 311 CO -0.14 -0.29 -0.26 0.24 -1.65 0.00 0.00 177.43 175.32 1xlj h MET 312 N -0.20 0.78 0.06 0.81 2.86 -1.51 -2.60 114.93 115.12 1xlj h MET 312 Ca 0.19 -0.33 -0.00 0.00 -2.06 0.00 0.00 59.70 57.50 1xlj h MET 312 Cb 0.51 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.15 1xlj h MET 312 CO -0.55 0.95 -0.03 1.03 1.06 0.00 0.00 176.91 179.38 1xlj h SER 313 N 0.67 -0.07 0.03 1.22 0.87 -1.10 0.90 113.55 116.06 1xlj h SER 313 Ca 0.08 -0.15 0.02 0.00 -1.23 0.00 0.00 61.79 60.52 1xlj h SER 313 Cb 0.78 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.73 1xlj h SER 313 CO 0.06 0.11 -0.14 0.24 -0.53 0.00 0.00 176.83 176.57 1xlj h MET 314 N -0.24 -0.24 -0.33 2.24 2.07 -0.72 0.97 114.93 118.68 1xlj h MET 314 Ca -0.01 0.02 0.07 0.00 -2.07 0.00 0.00 59.70 57.70 1xlj h MET 314 Cb 0.21 0.06 -0.06 0.00 -1.87 0.00 0.00 31.60 29.93 1xlj h MET 314 CO 0.01 -0.16 -0.08 -0.92 1.07 0.00 0.00 176.91 176.84 1xlj h TYR 315 N -0.25 -0.16 -0.60 -0.22 5.03 -1.41 -0.63 116.97 118.72 1xlj h TYR 315 Ca 0.04 0.03 -0.06 0.00 2.58 0.00 0.00 58.73 61.32 1xlj h TYR 315 Cb 0.30 0.12 -0.02 0.00 1.55 0.00 0.00 36.73 38.68 1xlj h TYR 315 CO -0.19 -0.13 0.13 -0.07 -1.32 0.00 0.00 178.16 176.57 1xlj h LEU 316 N 0.01 0.93 -0.59 2.82 3.38 -0.15 -1.49 115.31 120.21 1xlj h LEU 316 Ca 0.16 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.90 1xlj h LEU 316 Cb 0.24 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1xlj h LEU 316 CO -0.33 0.94 0.38 -0.07 0.09 0.00 0.00 178.44 179.44 1xlj h LEU 317 N 0.89 0.63 -0.42 1.67 3.38 -0.59 -1.63 115.31 119.23 1xlj h LEU 317 Ca 0.19 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 1xlj h LEU 317 Cb 0.38 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1xlj h LEU 317 CO 0.01 0.45 0.06 -0.07 0.09 0.00 0.00 178.44 178.98 1xlj h LEU 318 N 0.75 0.68 -0.26 1.67 3.38 -0.98 -2.76 115.31 117.79 1xlj h LEU 318 Ca 0.23 -0.26 0.04 0.00 0.09 0.00 0.00 57.88 57.98 1xlj h LEU 318 Cb -0.03 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 1xlj h LEU 318 CO -0.08 0.77 0.01 0.50 0.09 0.00 0.00 178.44 179.74 1xlj h LYS 319 N 0.56 0.09 0.12 1.13 3.64 -1.00 -0.40 116.57 120.71 1xlj h LYS 319 Ca 0.13 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.52 1xlj h LYS 319 Cb 0.39 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 1xlj h LYS 319 CO 0.01 0.06 -0.23 1.49 -2.27 0.00 0.00 179.45 178.51 1xlj h GLU 320 N 0.10 -0.42 -0.27 1.90 4.81 -1.25 -0.48 114.58 118.97 1xlj h GLU 320 Ca 0.12 0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.42 1xlj h GLU 320 Cb 0.15 0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.59 1xlj h GLU 320 CO -0.20 -0.28 0.03 0.00 -0.73 0.00 0.00 179.01 177.83 1xlj h ARG 321 N -0.43 0.11 0.00 1.92 3.08 -1.26 -2.14 114.38 115.66 1xlj h ARG 321 Ca 0.03 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 60.01 1xlj h ARG 321 Cb 0.45 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 1xlj h ARG 321 CO -0.13 0.08 -0.27 0.00 -1.07 0.00 0.00 179.97 178.58 1xlj h ALA 322 N 1.21 1.56 0.01 0.04 0.00 -0.94 -0.47 119.26 120.67 1xlj h ALA 322 Ca 0.12 -0.24 -0.26 0.00 0.00 0.00 0.00 54.91 54.53 1xlj h ALA 322 Cb 0.15 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 17.91 1xlj h ALA 322 CO -0.19 0.34 -1.05 -0.07 0.00 0.00 0.00 179.25 178.28 1xlj h LEU 323 N 0.00 0.83 -0.75 0.00 3.38 -0.76 -3.04 115.31 114.96 1xlj h LEU 323 Ca -0.00 -0.67 -0.10 0.00 0.09 0.00 0.00 57.88 57.20 1xlj h LEU 323 Cb 0.48 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1xlj h LEU 323 CO 0.03 1.48 -0.10 0.00 0.09 0.00 0.00 178.44 179.95 1xlj h ALA 324 N 0.47 0.94 0.33 1.53 0.00 -1.17 -2.74 119.26 118.62 1xlj h ALA 324 Ca -0.13 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 1xlj h ALA 324 Cb 1.70 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1xlj h ALA 324 CO 0.20 0.62 -0.16 0.35 0.00 0.00 0.00 179.25 180.26 1xlj h PHE 325 N 0.77 -0.41 0.00 0.00 3.57 -1.14 -2.43 116.94 117.30 1xlj h PHE 325 Ca 0.13 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.56 1xlj h PHE 325 Cb 0.60 0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 1xlj h PHE 325 CO 0.03 -0.22 -0.29 0.00 -2.23 0.00 0.00 178.31 175.61 1xlj h ARG 326 N -0.51 0.00 0.00 1.11 2.47 -1.55 -3.03 114.38 112.88 1xlj h ARG 326 Ca -0.05 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.64 1xlj h ARG 326 Cb 0.38 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.70 1xlj h ARG 326 CO 0.07 0.29 -0.18 0.00 0.56 0.00 0.00 179.97 180.72 1xlj h ALA 327 N 1.71 0.94 -2.27 0.04 0.00 -1.42 -3.44 119.26 114.81 1xlj h ALA 327 Ca -0.00 -0.16 -0.55 0.00 0.00 0.00 0.00 54.91 54.20 1xlj h ALA 327 Cb 0.79 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1xlj h ALA 327 CO 0.04 0.22 0.98 0.34 0.00 0.00 0.00 179.25 180.83 1xlj s ASP 328 N -6.16 6.77 0.27 0.00 -1.08 -0.92 -4.92 116.67 110.63 1xlj s ASP 328 Ca 0.03 2.10 -0.01 0.00 -0.52 0.00 0.00 52.55 54.15 1xlj s ASP 328 Cb 0.08 -2.54 0.47 0.00 -1.46 0.00 0.00 42.92 39.47 1xlj s ASP 328 CO 0.65 -0.84 1.84 -0.65 0.52 0.00 0.00 175.17 176.70 1xlj h PRO 329 N 8.77 0.97 -0.46 4.34 0.11 -1.89 -1.00 132.00 142.84 1xlj h PRO 329 Ca -0.36 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.65 1xlj h PRO 329 Cb 1.16 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 32.03 1xlj h PRO 329 CO 0.94 0.64 0.12 1.49 -0.21 0.00 0.00 178.00 180.99 1xlj h GLU 330 N 1.00 0.74 -0.45 1.05 4.81 -1.95 -0.82 114.58 118.96 1xlj h GLU 330 Ca 0.45 -0.17 -0.04 0.00 -0.13 0.00 0.00 59.36 59.47 1xlj h GLU 330 Cb 0.36 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1xlj h GLU 330 CO -0.23 0.73 0.12 0.28 -0.73 0.00 0.00 179.01 179.17 1xlj h VAL 331 N 0.62 1.23 -0.63 0.32 2.07 -1.62 -1.20 116.25 117.03 1xlj h VAL 331 Ca 0.15 -0.79 -0.05 0.00 0.82 0.00 0.00 66.70 66.83 1xlj h VAL 331 Cb 0.32 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 1xlj h VAL 331 CO 0.00 0.28 0.20 1.56 0.02 0.00 0.00 177.57 179.63 1xlj h GLN 332 N 0.59 0.96 0.13 1.57 1.08 -0.87 -2.18 115.11 116.38 1xlj h GLN 332 Ca 0.14 -0.19 -0.01 0.00 -1.45 0.00 0.00 58.65 57.15 1xlj h GLN 332 Cb 0.30 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 27.58 1xlj h GLN 332 CO -0.00 0.82 -0.06 1.49 -0.95 0.00 0.00 178.83 180.13 1xlj h GLU 333 N 0.93 -0.16 -1.00 1.46 4.81 -0.87 -2.35 114.58 117.39 1xlj h GLU 333 Ca 0.21 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.49 1xlj h GLU 333 Cb 0.26 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.62 1xlj h GLU 333 CO -0.01 -0.11 0.65 0.00 -0.73 0.00 0.00 179.01 178.82 1xlj h ALA 334 N 0.71 1.35 -0.71 2.92 0.00 -1.02 -1.49 119.26 121.02 1xlj h ALA 334 Ca -0.02 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1xlj h ALA 334 Cb 0.13 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1xlj h ALA 334 CO 0.03 0.56 0.18 0.52 0.00 0.00 0.00 179.25 180.53 1xlj h MET 335 N 1.27 1.13 -0.04 0.00 2.86 -1.27 -1.68 114.93 117.19 1xlj h MET 335 Ca 0.40 -0.27 -0.07 0.00 -2.06 0.00 0.00 59.70 57.70 1xlj h MET 335 Cb -0.00 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.51 1xlj h MET 335 CO -0.12 0.99 -0.25 -0.22 1.06 0.00 0.00 176.91 178.37 1xlj h LYS 336 N 1.08 0.24 -0.68 1.72 3.11 -1.02 -0.03 116.57 120.99 1xlj h LYS 336 Ca 0.22 -0.21 0.11 0.00 -2.81 0.00 0.00 60.65 57.97 1xlj h LYS 336 Cb 0.36 0.04 -0.08 0.00 -1.00 0.00 0.00 32.23 31.56 1xlj h LYS 336 CO 0.00 0.87 0.28 1.15 -2.81 0.00 0.00 179.45 178.94 1xlj h THR 337 N -0.31 0.75 0.00 1.00 2.02 -1.20 -1.95 112.91 113.22 1xlj h THR 337 Ca -0.02 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.00 1xlj h THR 337 Cb 0.92 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 1xlj h THR 337 CO 0.05 0.08 0.00 -1.20 0.37 0.00 0.00 175.52 174.83 1xlj n SER 338 N -4.97 0.00 -0.12 4.18 7.64 -0.64 -4.88 113.62 114.83 1xlj n SER 338 Ca 0.11 -0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.97 1xlj n SER 338 Cb 0.32 -0.31 -0.01 0.00 -1.01 0.00 0.00 64.21 63.20 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 0.85 0.48 0.32 0.23 0.00 -0.73 -4.96 105.19 101.38 1xlj n GLY 339 Ca 0.11 -1.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.11 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 1.22 0.04 1.61 2.07 -1.22 -1.41 116.25 118.56 1xlj h VAL 340 Ca -0.03 -0.66 -0.23 0.00 0.82 0.00 0.00 66.70 66.60 1xlj h VAL 340 Cb 0.18 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1xlj h VAL 340 CO 0.05 0.27 -1.05 -0.26 0.02 0.00 0.00 177.57 176.59 1xlj h PHE 341 N 0.89 0.18 -0.45 1.57 0.04 -1.87 -3.24 116.94 114.07 1xlj h PHE 341 Ca 0.21 -0.13 0.00 0.00 2.80 0.00 0.00 57.97 60.86 1xlj h PHE 341 Cb 0.16 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.27 1xlj h PHE 341 CO 0.01 1.07 0.30 0.93 -0.60 0.00 0.00 178.31 180.02 1xlj h GLU 342 N 0.03 0.60 -0.21 1.51 5.08 -1.70 -2.34 114.58 117.54 1xlj h GLU 342 Ca -0.05 -0.04 0.06 0.00 -1.00 0.00 0.00 59.36 58.33 1xlj h GLU 342 Cb 1.78 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.89 1xlj h GLU 342 CO 0.15 0.40 0.19 1.25 -1.00 0.00 0.00 179.01 180.00 1xlj h LEU 343 N 0.61 0.00 -1.61 1.33 5.85 -1.31 -2.55 115.31 117.63 1xlj h LEU 343 Ca 0.17 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1xlj h LEU 343 Cb -0.07 0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.96 1xlj h LEU 343 CO -0.04 0.00 0.00 1.23 -0.34 0.00 0.00 178.44 179.29 1xlj h GLY 344 N 0.00 0.00 -4.99 3.75 0.00 -1.62 -3.43 103.07 96.78 1xlj h GLY 344 Ca 0.10 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.87 1xlj h GLY 344 CO -0.00 0.00 0.44 -0.54 0.00 0.00 0.00 176.54 176.44 1xlj s GLU 345 N -3.71 4.38 0.51 4.80 2.02 -0.96 -5.02 118.70 120.71 1xlj s GLU 345 Ca 0.01 1.19 -0.22 0.00 0.02 0.00 0.00 54.97 55.97 1xlj s GLU 345 Cb 0.09 -3.54 -0.07 0.00 0.10 0.00 0.00 34.13 30.71 1xlj s GLU 345 CO 0.53 -0.27 1.15 0.25 0.02 0.00 0.00 175.26 176.94 1xlj n THR 346 N 4.51 3.20 0.05 3.63 -2.24 -1.26 -4.93 114.28 117.23 1xlj n THR 346 Ca 0.06 -0.50 -0.13 0.00 -2.27 0.00 0.00 64.05 61.21 1xlj n THR 346 Cb 0.49 -1.38 -0.09 0.00 -2.10 0.00 0.00 70.33 67.25 1xlj n THR 346 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1xlj h THR 347 N 1.33 1.10 -4.34 4.28 2.02 -1.95 -3.44 112.91 111.91 1xlj h THR 347 Ca -0.48 -0.82 -0.51 0.00 0.77 0.00 0.00 66.41 65.37 1xlj h THR 347 Cb 1.33 1.62 0.10 0.00 -1.74 0.00 0.00 68.15 69.45 1xlj h THR 347 CO 0.56 0.20 0.37 -0.76 0.37 0.00 0.00 175.52 176.25 1xlj s LEU 348 N -9.43 3.11 0.53 2.58 1.43 -1.26 -5.06 118.68 110.58 1xlj s LEU 348 Ca -0.15 1.61 -0.06 0.00 -1.03 0.00 0.00 54.13 54.50 1xlj s LEU 348 Cb 0.02 -4.47 -0.02 0.00 0.03 0.00 0.00 46.19 41.75 1xlj s LEU 348 CO 0.62 -1.47 0.85 0.20 0.23 0.00 0.00 176.35 176.78 1xlj s ASN 349 N -3.80 6.08 0.13 2.29 0.01 -1.26 -4.98 114.94 113.41 1xlj s ASN 349 Ca 0.58 0.94 -0.31 0.00 -0.71 0.00 0.00 52.86 53.36 1xlj s ASN 349 Cb -0.14 -2.13 -0.11 0.00 0.41 0.00 0.00 41.25 39.28 1xlj s ASN 349 CO 0.55 -0.75 1.84 0.00 -1.51 0.00 0.00 177.10 177.23 1xlj s ALA 350 N -2.87 3.78 -1.09 0.60 0.00 -1.26 -1.98 121.76 118.95 1xlj s ALA 350 Ca 0.50 1.48 -0.16 0.00 0.00 0.00 0.00 51.96 53.78 1xlj s ALA 350 Cb -0.10 -3.77 -0.02 0.00 0.00 0.00 0.00 23.12 19.23 1xlj s ALA 350 CO 0.46 -1.22 0.81 0.41 0.00 0.00 0.00 175.76 176.22 1xlj n GLY 351 N 4.24 -1.06 3.22 0.00 0.00 -1.26 -5.00 105.19 105.34 1xlj n GLY 351 Ca 0.18 0.49 -0.32 0.00 0.00 0.00 0.00 46.02 46.37 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 -5.48 3.07 0.52 1.61 2.12 -0.84 -5.14 118.70 114.56 1xlj s GLU 352 Ca 0.43 -0.86 0.07 0.00 0.36 0.00 0.00 54.97 54.97 1xlj s GLU 352 Cb -0.13 -2.35 0.07 0.00 0.26 0.00 0.00 34.13 31.98 1xlj s GLU 352 CO 0.83 0.14 0.62 -1.13 -0.54 0.00 0.00 175.26 175.18 1xlj n SER 353 N 3.64 2.14 0.18 -1.70 3.41 -1.26 -4.77 113.62 115.27 1xlj n SER 353 Ca -0.19 -2.51 -0.16 0.00 -0.26 0.00 0.00 58.87 55.75 1xlj n SER 353 Cb 0.53 -0.28 -0.09 0.00 -0.26 0.00 0.00 64.21 64.11 1xlj n SER 353 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xlj h ALA 354 N 0.32 -0.96 -0.34 7.33 0.00 -2.01 -0.22 119.26 123.38 1xlj h ALA 354 Ca -0.27 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.59 1xlj h ALA 354 Cb 1.15 0.76 -0.08 0.00 0.00 0.00 0.00 17.79 19.61 1xlj h ALA 354 CO 0.40 -1.10 -0.27 0.00 0.00 0.00 0.00 179.25 178.29 1xlj h ALA 355 N -0.52 -0.10 -0.72 0.00 0.00 -2.00 0.68 119.26 116.59 1xlj h ALA 355 Ca -0.02 0.10 0.11 0.00 0.00 0.00 0.00 54.91 55.10 1xlj h ALA 355 Cb 0.77 0.58 -0.08 0.00 0.00 0.00 0.00 17.79 19.07 1xlj h ALA 355 CO -0.19 -0.67 0.33 -0.44 0.00 0.00 0.00 179.25 178.29 1xlj h ASP 356 N -0.23 0.39 -0.21 0.00 3.32 -1.84 -2.92 116.42 114.94 1xlj h ASP 356 Ca 0.17 0.08 -0.06 0.00 0.02 0.00 0.00 57.03 57.23 1xlj h ASP 356 Cb 0.49 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.06 1xlj h ASP 356 CO -0.47 0.20 -0.10 0.25 -1.72 0.00 0.00 179.24 177.41 1xlj h LEU 357 N 0.54 0.44 -1.18 1.55 5.85 0.55 -1.93 115.31 121.13 1xlj h LEU 357 Ca 0.37 -0.41 0.05 0.00 0.84 0.00 0.00 57.88 58.73 1xlj h LEU 357 Cb 0.46 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.31 1xlj h LEU 357 CO -0.31 0.75 0.56 0.24 -0.34 0.00 0.00 178.44 179.34 1xlj h MET 358 N 0.13 1.00 -0.23 1.25 2.86 -0.74 -0.86 114.93 118.35 1xlj h MET 358 Ca 0.05 -0.06 -0.13 0.00 -2.06 0.00 0.00 59.70 57.50 1xlj h MET 358 Cb 0.59 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1xlj h MET 358 CO 0.03 0.66 -0.40 -0.97 1.06 0.00 0.00 176.91 177.29 1xlj h ASN 359 N 1.03 0.56 -2.11 1.22 -0.00 -1.66 -3.44 115.58 111.17 1xlj h ASN 359 Ca 0.35 -0.25 -0.57 0.00 -0.00 0.00 0.00 56.30 55.84 1xlj h ASN 359 Cb 0.10 -0.16 0.01 0.00 -0.00 0.00 0.00 38.32 38.27 1xlj h ASN 359 CO -0.11 0.90 1.41 -0.62 -0.00 0.00 0.00 177.43 179.00 1xlj s ASP 360 N -6.85 5.78 0.30 1.15 2.15 -0.33 -4.83 116.67 114.04 1xlj s ASP 360 Ca -0.07 2.17 0.01 0.00 0.43 0.00 0.00 52.55 55.09 1xlj s ASP 360 Cb 0.12 -2.52 0.53 0.00 -0.30 0.00 0.00 42.92 40.76 1xlj s ASP 360 CO 0.82 -1.66 1.90 -1.28 -0.17 0.00 0.00 175.17 174.78 1xlj h SER 361 N 13.59 0.92 -0.35 -0.34 0.87 -1.86 -2.52 113.55 123.85 1xlj h SER 361 Ca -0.44 0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.07 1xlj h SER 361 Cb 1.24 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 63.00 1xlj h SER 361 CO 0.95 0.57 0.00 0.00 -0.53 0.00 0.00 176.83 177.83 1xlj h ALA 362 N 1.51 1.18 0.01 6.23 0.00 -1.88 0.88 119.26 127.19 1xlj h ALA 362 Ca 0.41 -0.25 -0.20 0.00 0.00 0.00 0.00 54.91 54.87 1xlj h ALA 362 Cb 0.25 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1xlj h ALA 362 CO -0.17 0.54 -0.96 0.77 0.00 0.00 0.00 179.25 179.43 1xlj h SER 363 N 0.68 0.03 0.00 0.00 0.02 -1.79 -3.35 113.55 109.14 1xlj h SER 363 Ca 0.14 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1xlj h SER 363 Cb 0.41 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.94 1xlj h SER 363 CO 0.02 0.97 0.00 0.33 -1.14 0.00 0.00 176.83 177.01 1xlj n PHE 364 N -3.43 0.00 -0.28 3.45 7.35 -1.13 -4.76 117.46 118.66 1xlj n PHE 364 Ca -0.01 0.00 0.09 0.00 -0.76 0.00 0.00 57.45 56.77 1xlj n PHE 364 Cb 0.90 0.06 0.22 0.00 0.35 0.00 0.00 39.48 41.01 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 0.00 1.02 -1.00 3.13 0.00 -1.69 -1.29 119.26 119.43 1xlj h ALA 365 Ca 0.00 0.24 -0.55 0.00 0.00 0.00 0.00 54.91 54.60 1xlj h ALA 365 Cb 0.00 0.39 -0.43 0.00 0.00 0.00 0.00 17.79 17.76 1xlj h ALA 365 CO 0.00 -0.45 -0.81 0.41 0.00 0.00 0.00 179.25 178.40 1xlj n GLY 366 N -1.41 6.05 3.73 0.00 0.00 0.30 -5.02 105.19 108.85 1xlj n GLY 366 Ca 0.18 -2.63 -0.40 0.00 0.00 0.00 0.00 46.02 43.17 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 -3.58 3.64 -1.11 1.61 5.36 -0.49 -4.75 117.98 118.66 1xlj s PHE 367 Ca 0.49 1.31 -0.15 0.00 -0.96 0.00 0.00 56.93 57.63 1xlj s PHE 367 Cb 0.40 -2.79 0.17 0.00 -0.34 0.00 0.00 43.02 40.47 1xlj s PHE 367 CO -0.04 0.17 1.29 0.34 -1.46 0.00 0.00 175.22 175.53 1xlj s ASP 368 N 0.43 6.97 0.25 6.13 2.15 -1.26 -4.85 116.67 126.49 1xlj s ASP 368 Ca 0.37 -2.80 -0.03 0.00 0.43 0.00 0.00 52.55 50.52 1xlj s ASP 368 Cb -0.19 -2.37 0.46 0.00 -0.30 0.00 0.00 42.92 40.53 1xlj s ASP 368 CO 0.20 -0.77 1.78 0.00 -0.17 0.00 0.00 175.17 176.20 1xlj h ALA 369 N 7.56 1.20 -0.31 3.66 0.00 -1.96 0.17 119.26 129.57 1xlj h ALA 369 Ca 0.25 0.07 -0.16 0.00 0.00 0.00 0.00 54.91 55.07 1xlj h ALA 369 Cb 0.92 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1xlj h ALA 369 CO 1.16 -0.04 -0.43 0.93 0.00 0.00 0.00 179.25 180.88 1xlj h GLU 370 N 0.66 0.79 -0.21 0.00 4.39 -1.99 -1.78 114.58 116.44 1xlj h GLU 370 Ca 0.43 -0.43 -0.15 0.00 0.34 0.00 0.00 59.36 59.55 1xlj h GLU 370 Cb 0.53 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.19 1xlj h GLU 370 CO -0.32 1.06 -0.49 0.00 -1.16 0.00 0.00 179.01 178.10 1xlj h ALA 371 N 0.88 0.74 -0.53 3.43 0.00 -1.52 -3.12 119.26 119.14 1xlj h ALA 371 Ca 0.05 -0.49 -0.10 0.00 0.00 0.00 0.00 54.91 54.37 1xlj h ALA 371 Cb 0.99 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1xlj h ALA 371 CO 0.09 0.67 -0.05 0.00 0.00 0.00 0.00 179.25 179.97 1xlj h ALA 372 N 1.00 0.91 0.00 0.00 0.00 -0.94 -3.12 119.26 117.10 1xlj h ALA 372 Ca 0.02 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1xlj h ALA 372 Cb 1.03 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1xlj h ALA 372 CO 0.10 0.64 0.00 0.00 0.00 0.00 0.00 179.25 179.98 1xlj n ALA 373 N -2.49 1.12 0.17 0.00 0.00 -0.68 -2.04 120.51 116.61 1xlj n ALA 373 Ca 0.02 0.13 0.06 0.00 0.00 0.00 0.00 53.44 53.65 1xlj n ALA 373 Cb 0.36 -1.25 0.12 0.00 0.00 0.00 0.00 19.45 18.68 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 -6.37 0.00 5.08 -1.61 -3.47 114.58 108.21 1xlj h GLU 374 Ca 0.00 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.72 1xlj h GLU 374 Cb 0.05 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.35 1xlj h GLU 374 CO 0.00 0.33 0.62 -2.13 -1.00 0.00 0.00 179.01 176.82 1xlj n ARG 375 N -3.21 1.60 -2.89 2.33 0.63 -0.86 -4.92 116.66 109.34 1xlj n ARG 375 Ca 0.02 0.58 -0.43 0.00 -0.92 0.00 0.00 57.85 57.10 1xlj n ARG 375 Cb 0.64 -2.28 -0.04 0.00 0.45 0.00 0.00 32.46 31.23 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 0.75 6.27 0.31 6.15 2.47 -1.26 -4.93 114.94 124.70 1xlj s ASN 376 Ca 0.82 -0.63 0.09 0.00 0.42 0.00 0.00 52.86 53.57 1xlj s ASN 376 Cb -0.83 -2.41 0.49 0.00 -1.45 0.00 0.00 41.25 37.05 1xlj s ASN 376 CO 0.43 -1.24 1.70 -0.26 -3.72 0.00 0.00 177.10 174.02 1xlj h PHE 377 N 9.34 0.12 -5.27 0.43 0.04 -1.91 -3.46 116.94 116.23 1xlj h PHE 377 Ca -0.27 -0.04 -0.31 0.00 2.80 0.00 0.00 57.97 60.16 1xlj h PHE 377 Cb 1.08 -0.03 0.15 0.00 2.20 0.00 0.00 35.95 39.35 1xlj h PHE 377 CO 0.90 0.56 -0.67 0.00 -0.60 0.00 0.00 178.31 178.50 1xlj n ALA 378 N -2.46 -1.69 0.08 2.45 0.00 -1.26 -3.92 120.51 113.71 1xlj n ALA 378 Ca -0.02 0.02 -0.05 0.00 0.00 0.00 0.00 53.44 53.40 1xlj n ALA 378 Cb 0.50 -2.71 -0.06 0.00 0.00 0.00 0.00 19.45 17.18 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 -1.83 0.00 0.02 0.00 0.04 -1.96 -2.82 116.94 110.39 1xlj h PHE 379 Ca -0.52 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.25 1xlj h PHE 379 Cb 1.31 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.46 1xlj h PHE 379 CO 0.40 0.87 -0.01 0.82 -0.60 0.00 0.00 178.31 179.79 1xlj h ILE 380 N 0.00 1.10 -0.55 -0.55 2.04 -1.99 -1.44 117.51 116.13 1xlj h ILE 380 Ca -0.01 -0.37 -0.05 0.00 1.00 0.00 0.00 64.86 65.43 1xlj h ILE 380 Cb 1.63 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 39.04 1xlj h ILE 380 CO 0.11 0.09 0.14 -0.09 0.00 0.00 0.00 178.15 178.41 1xlj h ARG 381 N -0.19 0.87 -0.92 2.37 2.43 -1.96 -0.44 114.38 116.54 1xlj h ARG 381 Ca -0.00 -0.20 0.06 0.00 -0.81 0.00 0.00 59.98 59.03 1xlj h ARG 381 Cb 0.18 -0.12 -0.06 0.00 -0.42 0.00 0.00 29.97 29.54 1xlj h ARG 381 CO 0.00 0.81 0.58 1.25 -1.51 0.00 0.00 179.97 181.11 1xlj h LEU 382 N 0.77 0.93 -0.55 3.80 5.85 -1.39 -1.61 115.31 123.11 1xlj h LEU 382 Ca 0.17 0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.77 1xlj h LEU 382 Cb 0.33 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 1xlj h LEU 382 CO 0.00 0.59 -0.29 -1.13 -0.34 0.00 0.00 178.44 177.27 1xlj h ASN 383 N 1.06 0.89 -0.42 1.25 -1.24 -0.65 -2.01 115.58 114.47 1xlj h ASN 383 Ca 0.40 -0.36 -0.02 0.00 0.71 0.00 0.00 56.30 57.03 1xlj h ASN 383 Cb 0.17 -0.25 -0.02 0.00 0.73 0.00 0.00 38.32 38.95 1xlj h ASN 383 CO -0.17 1.12 0.19 -0.61 -1.29 0.00 0.00 177.43 176.66 1xlj h GLN 384 N 0.73 0.62 -0.57 6.67 5.75 -0.62 -1.87 115.11 125.82 1xlj h GLN 384 Ca 0.08 -0.10 0.01 0.00 -0.15 0.00 0.00 58.65 58.49 1xlj h GLN 384 Cb 0.84 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 29.26 1xlj h GLN 384 CO 0.07 0.56 0.37 -0.07 -2.65 0.00 0.00 178.83 177.12 1xlj h LEU 385 N 0.54 0.64 0.13 -2.39 3.38 -1.22 -1.16 115.31 115.23 1xlj h LEU 385 Ca 0.14 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1xlj h LEU 385 Cb 0.16 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1xlj h LEU 385 CO -0.01 0.46 -0.09 0.00 0.09 0.00 0.00 178.44 178.89 1xlj h ALA 386 N 1.21 -0.21 -0.53 1.53 0.00 -1.01 -2.42 119.26 117.83 1xlj h ALA 386 Ca 0.21 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.13 1xlj h ALA 386 Cb -0.08 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1xlj h ALA 386 CO -0.05 -0.63 0.28 0.82 0.00 0.00 0.00 179.25 179.68 1xlj h ILE 387 N -0.23 0.98 -0.34 0.00 1.08 -1.09 -1.31 117.51 116.60 1xlj h ILE 387 Ca -0.01 -0.19 -0.00 0.00 -0.39 0.00 0.00 64.86 64.27 1xlj h ILE 387 Cb 0.20 0.38 -0.02 0.00 -3.07 0.00 0.00 36.82 34.32 1xlj h ILE 387 CO -0.01 0.10 0.20 -0.33 -0.69 0.00 0.00 178.15 177.42 1xlj h GLU 388 N 0.55 0.46 -0.15 2.37 5.08 -1.14 -1.89 114.58 119.85 1xlj h GLU 388 Ca 0.23 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.49 1xlj h GLU 388 Cb 0.11 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.26 1xlj h GLU 388 CO -0.14 0.33 -0.14 0.45 -1.00 0.00 0.00 179.01 178.50 1xlj h HIS 389 N 0.47 0.44 -0.84 4.33 3.86 -0.84 -1.54 115.15 121.02 1xlj h HIS 389 Ca 0.12 -0.13 0.11 0.00 -1.16 0.00 0.00 60.37 59.32 1xlj h HIS 389 Cb -0.01 -0.09 -0.06 0.00 1.06 0.00 0.00 27.41 28.31 1xlj h HIS 389 CO 0.00 0.75 0.55 1.25 0.86 0.00 0.00 177.93 181.34 1xlj h LEU 390 N 0.00 0.68 -0.36 2.43 5.85 -0.57 -2.39 115.31 120.95 1xlj h LEU 390 Ca 0.03 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1xlj h LEU 390 Cb 0.67 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.58 1xlj h LEU 390 CO 0.04 0.39 -0.16 0.18 -0.34 0.00 0.00 178.44 178.54 1xlj n LEU 391 N -4.53 0.73 -3.58 2.25 4.77 -0.78 -4.96 117.00 110.90 1xlj n LEU 391 Ca 0.15 -0.12 -0.21 0.00 -0.03 0.00 0.00 56.01 55.80 1xlj n LEU 391 Cb 0.37 -0.15 0.05 0.00 -2.33 0.00 0.00 43.42 41.36 1xlj n LEU 391 CO 0.31 0.13 -0.03 0.61 -1.33 0.00 0.00 177.39 177.09 1xlj n GLY 392 N 1.30 -0.56 0.44 -0.72 0.00 -0.90 -4.89 105.19 99.86 1xlj n GLY 392 Ca 0.14 0.25 0.05 0.00 0.00 0.00 0.00 46.02 46.46 1xlj n GLY 392 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xlj n SER 393 N -3.04 2.06 0.00 1.61 3.41 -0.59 -5.05 113.62 112.01 1xlj n SER 393 Ca -0.23 -1.54 0.00 0.00 -0.26 0.00 0.00 58.87 56.84 1xlj n SER 393 Cb 0.65 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.56 1xlj n SER 393 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42